5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)

C125H149Cl2F3N12O18 — CID 159020879

IUPAC5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)
SMILESCC(F)(F)c1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)c(F)c1.Cc1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)cc1.Cc1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)cc1.Cc1ccccc1COCc1ccc(C(=O)NCC2CCOCC2)nc1.O=C(NCC1CCOCC1)c1ccc(COCc2cccc(Cl)c2)cn1.O=C(NCC1CCOCC1)c1ccc(COCc2ccccc2Cl)cn1
InChIInChI=1S/C22H25F3N2O3.3C21H26N2O3.2C20H23ClN2O3/c1-22(24,25)18-4-3-17(19(23)10-18)14-30-13-16-2-5-20(26-12-16)21(28)27-11-15-6-8-29-9-7-15;2*1-16-2-4-18(5-3-16)14-26-15-19-6-7-20(22-13-19)21(24)23-12-17-8-10-25-11-9-17;1-16-4-2-3-5-19(16)15-26-14-18-6-7-20(22-13-18)21(24)23-12-17-8-10-25-11-9-17;21-18-3-1-2-16(10-18)13-26-14-17-4-5-19(22-12-17)20(24)23-11-15-6-8-25-9-7-15;21-18-4-2-1-3-17(18)14-26-13-16-5-6-19(22-12-16)20(24)23-11-15-7-9-25-10-8-15/h2-5,10,12,15H,6-9,11,13-14H2,1H3,(H,27,28);3*2-7,13,17H,8-12,14-15H2,1H3,(H,23,24);1-5,10,12,15H,6-9,11,13-14H2,(H,23,24);1-6,12,15H,7-11,13-14H2,(H,23,24)
InChIKeyJTRHUPOWXWTYNR-UHFFFAOYSA-N
MW2235.53 g/mol
LogP21.21
Rot. Bonds43

About 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)

5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide) (PubChem CID 159020879) has the molecular formula C125H149Cl2F3N12O18 and a molecular weight of 2235.53 g/mol. Its IUPAC name is 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide).

Molecular Properties

Compound Name5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)
PubChem CID159020879
Molecular FormulaC125H149Cl2F3N12O18
Molecular Weight2235.53 g/mol
Exact Mass2233.04
IUPAC Name5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)
SMILESCC(F)(F)c1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)c(F)c1.Cc1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)cc1.Cc1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)cc1.Cc1ccccc1COCc1ccc(C(=O)NCC2CCOCC2)nc1.O=C(NCC1CCOCC1)c1ccc(COCc2cccc(Cl)c2)cn1.O=C(NCC1CCOCC1)c1ccc(COCc2ccccc2Cl)cn1
InChIInChI=1S/C22H25F3N2O3.3C21H26N2O3.2C20H23ClN2O3/c1-22(24,25)18-4-3-17(19(23)10-18)14-30-13-16-2-5-20(26-12-16)21(28)27-11-15-6-8-29-9-7-15;2*1-16-2-4-18(5-3-16)14-26-15-19-6-7-20(22-13-19)21(24)23-12-17-8-10-25-11-9-17;1-16-4-2-3-5-19(16)15-26-14-18-6-7-20(22-13-18)21(24)23-12-17-8-10-25-11-9-17;21-18-3-1-2-16(10-18)13-26-14-17-4-5-19(22-12-17)20(24)23-11-15-6-8-25-9-7-15;21-18-4-2-1-3-17(18)14-26-13-16-5-6-19(22-12-16)20(24)23-11-15-7-9-25-10-8-15/h2-5,10,12,15H,6-9,11,13-14H2,1H3,(H,27,28);3*2-7,13,17H,8-12,14-15H2,1H3,(H,23,24);1-5,10,12,15H,6-9,11,13-14H2,(H,23,24);1-6,12,15H,7-11,13-14H2,(H,23,24)
InChIKeyJTRHUPOWXWTYNR-UHFFFAOYSA-N
XLogP21.21
TPSA362.70 Ų
H-Bond Donors6
H-Bond Acceptors24
Rotatable Bonds43
Heavy Atoms160
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002235.53
LogP ≤ 521.21
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1024

Analyze 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide) with MolForge

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Related Compounds

5-[2-[3-(1,1-difluoroethyl)-5-fluorophenoxy]ethyl]-N-(2-methylbutyl)pyridine-2-carboxamide;5-[[2-(1,1-difluoroethyl)phenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenoxy]ethyl]-N-(2-methylpropyl)pyridine-2-carboxamide;5-[(3-fluoro-4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-fluorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[2-[3-fluoro-5-(trifluoromethyl)phenoxy]ethyl]-N-(2-methylpropyl)pyridine-2-carboxamide
CID 157907869
[6-[2,4-Bis(trifluoromethyl)phenyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2,5-dichlorophenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2,5-difluorophenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2,3-dimethylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-fluoro-3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(6-methoxy-3-pyridinyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;2-[6-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]benzonitrile
CID 159612320
N-(1-adamantyl)-6-(2-chlorophenyl)pyridine-2-carboxamide;N-(1-adamantyl)-6-(2,3-dihydro-1-benzofuran-5-yl)pyridine-2-carboxamide;N-(1-adamantyl)-6-(2-fluorophenyl)pyridine-2-carboxamide;N-(1-adamantyl)-6-(2-methoxyphenyl)pyridine-2-carboxamide;N-(1-adamantyl)-6-pyridin-4-ylpyridine-2-carboxamide;N-(1-adamantyl)-6-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 160078017
5-[2-[4-chloro-3-(2,2-difluoropropyl)phenoxy]ethyl]-N-(2-methylpropyl)pyridine-2-carboxamide;5-[2-(3-chloro-5-methylphenoxy)ethyl]-N-(2-methylpropyl)pyridine-2-carboxamide;5-[[3-(1,1-difluoroethoxy)-4-fluorophenyl]methoxymethyl]-N-(2-methylpropyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(2-methylpropyl)pyridine-2-carboxamide;N-(2-methylpropyl)-5-[[4-methyl-3-(trifluoromethoxy)phenyl]methoxymethyl]pyridine-2-carboxamide;N-(2-methylpropyl)-5-[[3-methyl-5-(trifluoromethyl)phenyl]methoxymethyl]pyridine-2-carboxamide
CID 160426571
(3S)-N-[(2S)-3-(2-chloro-4-propanoylphenyl)-2-(dimethylamino)propyl]-3-(5-chloro-3-pyridinyl)-3-[1-(1,1-difluoroethyl)cyclopropyl]propanamide;(3R)-N-[(2S)-3-(2-chloro-4-propanoylphenyl)-2-(dimethylamino)propyl]-3-(5-chloro-3-pyridinyl)-3-[1-(1,1-difluoroethyl)cyclopropyl]propanamide;N-[(2S)-3-(2-chloro-4-propanoylphenyl)-2-(dimethylamino)propyl]-3-[1-(1,1-difluoroethyl)cyclopropyl]-3-(5-fluoro-3-pyridinyl)propanamide;N-[(2S)-3-(2-chloro-4-propanoylphenyl)-2-(dimethylamino)propyl]-3-[1-(1,1-difluoroethyl)cyclopropyl]-3-(6-methoxy-3-pyridinyl)propanamide;(3R)-N-[(2S)-3-(2-chloro-4-propanoylphenyl)-2-(dimethylamino)propyl]-3-[1-(1,1-difluoroethyl)cyclopropyl]-3-(6-methyl-3-pyridinyl)propanamide
CID 167699893
N-benzyl-4-(4-chlorophenyl)-3-(methoxymethyl)benzamide;4-(4-chlorophenyl)-N-(cyclohexylmethyl)-3-(methoxymethyl)benzamide;4-(4-chlorophenyl)-3-(methoxymethyl)-N-(pyridin-2-ylmethyl)benzamide;4-(4-chlorophenyl)-3-(methoxymethyl)-N-(pyridin-3-ylmethyl)benzamide;4-(4-chlorophenyl)-3-(methoxymethyl)-N-(pyridin-4-ylmethyl)benzamide
CID 161547505

Frequently Asked Questions

What is the IUPAC name of 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)?
The IUPAC name of 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide) (CID 159020879) is 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide).
What is the SMILES notation for 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)?
The canonical SMILES for 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide) is CC(F)(F)c1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)c(F)c1.Cc1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)cc1.Cc1ccc(COCc2ccc(C(=O)NCC3CCOCC3)nc2)cc1.Cc1ccccc1COCc1ccc(C(=O)NCC2CCOCC2)nc1.O=C(NCC1CCOCC1)c1ccc(COCc2cccc(Cl)c2)cn1.O=C(NCC1CCOCC1)c1ccc(COCc2ccccc2Cl)cn1.
What is the InChIKey of 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)?
The InChIKey is JTRHUPOWXWTYNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25F3N2O3.3C21H26N2O3.2C20H23ClN2O3/c1-22(24,25)18-4-3-17(19(23)10-18)14-30-13-16-2-5-20(26-12-16)21(28)27-11-15-6-8-29-9-7-15;2*1-16-2-4-18(5-3-16)14-26-15-19-6-7-20(22-13-19)21(24)23-12-17-8-10-25-11-9-17;1-16-4-2-3-5-19(16)15-26-14-18-6-7-20(22-13-18)21(24)23-12-17-8-10-25-11-9-17;21-18-3-1-2-16(10-18)13-26-14-17-4-5-19(22-12-17)20(24)23-11-15-6-8-25-9-7-15;21-18-4-2-1-3-17(18)14-26-13-16-5-6-19(22-12-16)20(24)23-11-15-7-9-25-10-8-15/h2-5,10,12,15H,6-9,11,13-14H2,1H3,(H,27,28);3*2-7,13,17H,8-12,14-15H2,1H3,(H,23,24);1-5,10,12,15H,6-9,11,13-14H2,(H,23,24);1-6,12,15H,7-11,13-14H2,(H,23,24).
What are the key properties of 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide)?
5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide) has a molecular weight of 2235.53 g/mol, XLogP of 21.21, 43 rotatable bonds, 6 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-chlorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[[4-(1,1-difluoroethyl)-2-fluorophenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(2-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;bis(5-[(4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide) is sourced from PubChem (CID 159020879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).