N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)

C193H235Cl5F2N28O16 — CID 159693443

IUPACN-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)
SMILESCN(Cc1ccc(CN2CCN(CC3CC3)CC2)nc1)C(=O)Cc1ccc(Cl)cc1Cl.COc1cc(C)ccc1NC(=O)CCc1ccc(OC2CCN(CC3CC3)CC2)nc1.Cc1ccc(NC(=O)CCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c(Cl)c1.Cc1ccc2c(ccn2C(=O)NCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c1.Cc1ccc2c(ccn2C(=O)NCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c1.O=C(CCc1ccc(OC2CCN(CC3CC3)CC2)nc1)Nc1ccc(Cl)cc1Cl.O=C(CCc1ccc(OC2CCN(CC3CC3)CC2)nc1)Nc1ccc(F)cc1F.[C-]#[N+]c1ccc(NC(=O)CCc2ccc(OC3CCN(CC4CC4)CC3)nc2)cc1
InChIInChI=1S/2C25H30N4O2.C25H33N3O3.C24H30Cl2N4O.C24H30ClN3O2.C24H28N4O2.C23H27Cl2N3O2.C23H27F2N3O2/c2*1-18-2-6-23-21(14-18)8-13-29(23)25(30)27-16-20-5-7-24(26-15-20)31-22-9-11-28(12-10-22)17-19-3-4-19;1-18-3-8-22(23(15-18)30-2)27-24(29)9-6-19-7-10-25(26-16-19)31-21-11-13-28(14-12-21)17-20-4-5-20;1-28(24(31)12-20-5-6-21(25)13-23(20)26)15-19-4-7-22(27-14-19)17-30-10-8-29(9-11-30)16-18-2-3-18;1-17-2-7-22(21(25)14-17)27-23(29)8-5-18-6-9-24(26-15-18)30-20-10-12-28(13-11-20)16-19-3-4-19;1-25-20-6-8-21(9-7-20)27-23(29)10-4-18-5-11-24(26-16-18)30-22-12-14-28(15-13-22)17-19-2-3-19;2*24-18-5-6-21(20(25)13-18)27-22(29)7-3-16-4-8-23(26-14-16)30-19-9-11-28(12-10-19)15-17-1-2-17/h2*2,5-8,13-15,19,22H,3-4,9-12,16-17H2,1H3,(H,27,30);3,7-8,10,15-16,20-21H,4-6,9,11-14,17H2,1-2H3,(H,27,29);4-7,13-14,18H,2-3,8-12,15-17H2,1H3;2,6-7,9,14-15,19-20H,3-5,8,10-13,16H2,1H3,(H,27,29);5-9,11,16,19,22H,2-4,10,12-15,17H2,(H,27,29);2*4-6,8,13-14,17,19H,1-3,7,9-12,15H2,(H,27,29)
InChIKeyMWRXEDQQMTUWMD-UHFFFAOYSA-N
MW3418.44 g/mol
LogP35.77
Rot. Bonds61

About N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)

N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide) (PubChem CID 159693443) has the molecular formula C193H235Cl5F2N28O16 and a molecular weight of 3418.44 g/mol. Its IUPAC name is N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide).

Molecular Properties

Compound NameN-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)
PubChem CID159693443
Molecular FormulaC193H235Cl5F2N28O16
Molecular Weight3418.44 g/mol
Exact Mass3413.68
IUPAC NameN-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)
SMILESCN(Cc1ccc(CN2CCN(CC3CC3)CC2)nc1)C(=O)Cc1ccc(Cl)cc1Cl.COc1cc(C)ccc1NC(=O)CCc1ccc(OC2CCN(CC3CC3)CC2)nc1.Cc1ccc(NC(=O)CCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c(Cl)c1.Cc1ccc2c(ccn2C(=O)NCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c1.Cc1ccc2c(ccn2C(=O)NCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c1.O=C(CCc1ccc(OC2CCN(CC3CC3)CC2)nc1)Nc1ccc(Cl)cc1Cl.O=C(CCc1ccc(OC2CCN(CC3CC3)CC2)nc1)Nc1ccc(F)cc1F.[C-]#[N+]c1ccc(NC(=O)CCc2ccc(OC3CCN(CC4CC4)CC3)nc2)cc1
InChIInChI=1S/2C25H30N4O2.C25H33N3O3.C24H30Cl2N4O.C24H30ClN3O2.C24H28N4O2.C23H27Cl2N3O2.C23H27F2N3O2/c2*1-18-2-6-23-21(14-18)8-13-29(23)25(30)27-16-20-5-7-24(26-15-20)31-22-9-11-28(12-10-22)17-19-3-4-19;1-18-3-8-22(23(15-18)30-2)27-24(29)9-6-19-7-10-25(26-16-19)31-21-11-13-28(14-12-21)17-20-4-5-20;1-28(24(31)12-20-5-6-21(25)13-23(20)26)15-19-4-7-22(27-14-19)17-30-10-8-29(9-11-30)16-18-2-3-18;1-17-2-7-22(21(25)14-17)27-23(29)8-5-18-6-9-24(26-15-18)30-20-10-12-28(13-11-20)16-19-3-4-19;1-25-20-6-8-21(9-7-20)27-23(29)10-4-18-5-11-24(26-16-18)30-22-12-14-28(15-13-22)17-19-2-3-19;2*24-18-5-6-21(20(25)13-18)27-22(29)7-3-16-4-8-23(26-14-16)30-19-9-11-28(12-10-19)15-17-1-2-17/h2*2,5-8,13-15,19,22H,3-4,9-12,16-17H2,1H3,(H,27,30);3,7-8,10,15-16,20-21H,4-6,9,11-14,17H2,1-2H3,(H,27,29);4-7,13-14,18H,2-3,8-12,15-17H2,1H3;2,6-7,9,14-15,19-20H,3-5,8,10-13,16H2,1H3,(H,27,29);5-9,11,16,19,22H,2-4,10,12-15,17H2,(H,27,29);2*4-6,8,13-14,17,19H,1-3,7,9-12,15H2,(H,27,29)
InChIKeyMWRXEDQQMTUWMD-UHFFFAOYSA-N
XLogP35.77
TPSA444.35 Ų
H-Bond Donors7
H-Bond Acceptors35
Rotatable Bonds61
Heavy Atoms244
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003418.44
LogP ≤ 535.77
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide) with MolForge

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Related Compounds

3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide
CID 58407732
N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide
CID 58407704
N-[[6-[1-[(2-chloro-4-fluorophenyl)methyl]piperidin-4-yl]oxy-3-pyridinyl]methyl]-3-methylbutanamide
CID 46190819
3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-[5-methyl-2-(trifluoromethyl)furan-3-yl]propanamide
CID 58407734
1-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 45376291
N-[[6-[1-[(3-chloro-4-fluorophenyl)methyl]piperidin-4-yl]oxy-3-pyridinyl]methyl]-3-methylbutanamide
CID 46190049
N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-3-methylbutanamide
CID 46190005
2-(2,4-dichlorophenyl)-N-[(6-methoxy-3-pyridinyl)methyl]acetamide
CID 51303949
1-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]-3-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]urea
CID 55743504
2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(2-fluoro-4-methylphenyl)acetamide
CID 9390252
4-(5-chloroindol-1-yl)-N-[(6-methoxy-3-pyridinyl)methyl]butanamide
CID 91646463
2-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-N-(4-methylphenyl)acetamide
CID 22194491

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)?
The IUPAC name of N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide) (CID 159693443) is N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide).
What is the SMILES notation for N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)?
The canonical SMILES for N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide) is CN(Cc1ccc(CN2CCN(CC3CC3)CC2)nc1)C(=O)Cc1ccc(Cl)cc1Cl.COc1cc(C)ccc1NC(=O)CCc1ccc(OC2CCN(CC3CC3)CC2)nc1.Cc1ccc(NC(=O)CCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c(Cl)c1.Cc1ccc2c(ccn2C(=O)NCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c1.Cc1ccc2c(ccn2C(=O)NCc2ccc(OC3CCN(CC4CC4)CC3)nc2)c1.O=C(CCc1ccc(OC2CCN(CC3CC3)CC2)nc1)Nc1ccc(Cl)cc1Cl.O=C(CCc1ccc(OC2CCN(CC3CC3)CC2)nc1)Nc1ccc(F)cc1F.[C-]#[N+]c1ccc(NC(=O)CCc2ccc(OC3CCN(CC4CC4)CC3)nc2)cc1.
What is the InChIKey of N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)?
The InChIKey is MWRXEDQQMTUWMD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H30N4O2.C25H33N3O3.C24H30Cl2N4O.C24H30ClN3O2.C24H28N4O2.C23H27Cl2N3O2.C23H27F2N3O2/c2*1-18-2-6-23-21(14-18)8-13-29(23)25(30)27-16-20-5-7-24(26-15-20)31-22-9-11-28(12-10-22)17-19-3-4-19;1-18-3-8-22(23(15-18)30-2)27-24(29)9-6-19-7-10-25(26-16-19)31-21-11-13-28(14-12-21)17-20-4-5-20;1-28(24(31)12-20-5-6-21(25)13-23(20)26)15-19-4-7-22(27-14-19)17-30-10-8-29(9-11-30)16-18-2-3-18;1-17-2-7-22(21(25)14-17)27-23(29)8-5-18-6-9-24(26-15-18)30-20-10-12-28(13-11-20)16-19-3-4-19;1-25-20-6-8-21(9-7-20)27-23(29)10-4-18-5-11-24(26-16-18)30-22-12-14-28(15-13-22)17-19-2-3-19;2*24-18-5-6-21(20(25)13-18)27-22(29)7-3-16-4-8-23(26-14-16)30-19-9-11-28(12-10-19)15-17-1-2-17/h2*2,5-8,13-15,19,22H,3-4,9-12,16-17H2,1H3,(H,27,30);3,7-8,10,15-16,20-21H,4-6,9,11-14,17H2,1-2H3,(H,27,29);4-7,13-14,18H,2-3,8-12,15-17H2,1H3;2,6-7,9,14-15,19-20H,3-5,8,10-13,16H2,1H3,(H,27,29);5-9,11,16,19,22H,2-4,10,12-15,17H2,(H,27,29);2*4-6,8,13-14,17,19H,1-3,7,9-12,15H2,(H,27,29).
What are the key properties of N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide)?
N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide) has a molecular weight of 3418.44 g/mol, XLogP of 35.77, 61 rotatable bonds, 7 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methylphenyl)-3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]propanamide;N-[[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-3-pyridinyl]methyl]-2-(2,4-dichlorophenyl)-N-methylacetamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-dichlorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2,4-difluorophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(4-isocyanophenyl)propanamide;3-[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]-N-(2-methoxy-4-methylphenyl)propanamide;bis(N-[[6-[1-(cyclopropylmethyl)piperidin-4-yl]oxy-3-pyridinyl]methyl]-5-methylindole-1-carboxamide) is sourced from PubChem (CID 159693443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).