N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide

C94H110ClFN12O6 — CID 160892868

IUPACN-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide
SMILESCN(CC1CCN(Cc2ccccc2Cl)CC1)C(=O)c1cc2ccccc2[nH]1.CN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1cc2ccccc2[nH]1.COc1ccc(CN2CCC(CN(C)C(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1ccccc1CN1CCC(CN(C)C(=O)c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/2C24H29N3O2.C23H26ClN3O.C23H26FN3O/c1-26(24(28)22-15-19-7-3-5-9-21(19)25-22)16-18-11-13-27(14-12-18)17-20-8-4-6-10-23(20)29-2;1-26(24(28)23-15-20-5-3-4-6-22(20)25-23)16-19-11-13-27(14-12-19)17-18-7-9-21(29-2)10-8-18;2*1-26(23(28)22-14-18-6-3-5-9-21(18)25-22)15-17-10-12-27(13-11-17)16-19-7-2-4-8-20(19)24/h3-10,15,18,25H,11-14,16-17H2,1-2H3;3-10,15,19,25H,11-14,16-17H2,1-2H3;2*2-9,14,17,25H,10-13,15-16H2,1H3
InChIKeySOMQBZJZXONLFP-UHFFFAOYSA-N
MW1558.44 g/mol
LogP17.42
Rot. Bonds22

About N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide

N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide (PubChem CID 160892868) has the molecular formula C94H110ClFN12O6 and a molecular weight of 1558.44 g/mol. Its IUPAC name is N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide
PubChem CID160892868
Molecular FormulaC94H110ClFN12O6
Molecular Weight1558.44 g/mol
Exact Mass1556.83
IUPAC NameN-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide
SMILESCN(CC1CCN(Cc2ccccc2Cl)CC1)C(=O)c1cc2ccccc2[nH]1.CN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1cc2ccccc2[nH]1.COc1ccc(CN2CCC(CN(C)C(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1ccccc1CN1CCC(CN(C)C(=O)c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/2C24H29N3O2.C23H26ClN3O.C23H26FN3O/c1-26(24(28)22-15-19-7-3-5-9-21(19)25-22)16-18-11-13-27(14-12-18)17-20-8-4-6-10-23(20)29-2;1-26(24(28)23-15-20-5-3-4-6-22(20)25-23)16-19-11-13-27(14-12-19)17-18-7-9-21(29-2)10-8-18;2*1-26(23(28)22-14-18-6-3-5-9-21(18)25-22)15-17-10-12-27(13-11-17)16-19-7-2-4-8-20(19)24/h3-10,15,18,25H,11-14,16-17H2,1-2H3;3-10,15,19,25H,11-14,16-17H2,1-2H3;2*2-9,14,17,25H,10-13,15-16H2,1H3
InChIKeySOMQBZJZXONLFP-UHFFFAOYSA-N
XLogP17.42
TPSA175.82 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds22
Heavy Atoms114
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001558.44
LogP ≤ 517.42
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

Analyze N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide with MolForge

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Related Compounds

N-[2-[[2,2-bis(4-fluorophenyl)-5-[4-(2-methoxyphenyl)piperidin-1-yl]pentyl]amino]-2-oxoethyl]-5-chloro-1H-indole-2-carboxamide
CID 9939913
7-fluoro-N-[(2S)-1-[(1S,4S)-5-(6-methoxy-1H-indole-2-carbonyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-1H-indole-2-carboxamide
CID 67072617
7-fluoro-N-[1-[5-(6-methoxy-1H-indole-2-carbonyl)-7-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-1H-indole-2-carboxamide
CID 91550537
N-[(2S)-1-[(1S,4S)-5-[2-chloro-5-(trifluoromethyl)benzoyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-1H-indole-2-carboxamide;N-[(2S)-1-[(1S,4S)-5-(2-methoxy-4-methylbenzoyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-1H-indole-2-carboxamide
CID 134247244
5-chloro-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;5-methyl-N-[(4-methylphenyl)methyl]-1H-indole-2-carboxamide;5-methyl-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
CID 157497105
(E)-4-[3-chloro-5-fluoro-4-[6-fluoro-2-(2-fluoro-2-methylpropyl)-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]but-3-en-2-one;(E)-4-[3,5-dichloro-4-[2-(2,2-difluoropropyl)-6-fluoro-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]but-3-en-2-one;(E)-4-[3,5-dichloro-4-[6-fluoro-2-(2-fluoro-2-methylpropyl)-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]but-3-en-2-one;(E)-4-[3,5-dichloro-4-[2-(2-fluoro-2-methylpropyl)-3-methyl-3,4-dihydro-1H-[1]benzofuro[2,3-c]pyridin-1-yl]phenyl]but-3-en-2-one
CID 157579984
(E)-4-[3-chloro-5-fluoro-4-[6-fluoro-2-(2-fluoro-2-methylpropyl)-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]but-3-en-2-one;(E)-4-[3,5-dichloro-4-[2-(2,2-difluoropropyl)-6-fluoro-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]but-3-en-2-one;(E)-4-[3,5-dichloro-4-[6-fluoro-2-(2-fluoro-2-methylpropyl)-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]but-3-en-2-one;(E)-4-[3,5-dichloro-4-[2-(2-fluoro-2-methylpropyl)-3-methyl-3,4-dihydro-1H-[1]benzofuro[2,3-c]pyridin-1-yl]phenyl]but-3-en-2-one;methane
CID 158080398
5-chloro-N-[[1-[2-(4-methoxyphenyl)propan-2-yl]piperidin-3-yl]methyl]-N-(2,2,2-trifluoroethyl)-1H-indole-2-carboxamide;5-chloro-N-(piperidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)-1H-indole-2-carboxamide;1-(2-chloropropan-2-yl)-4-methoxybenzene;methane
CID 158261374
N-(cyclohexylmethyl)-N-ethyl-5,6-dimethoxy-1H-indole-2-carboxamide;N-(cyclohexylmethyl)-N-ethyl-5-fluoro-1H-indole-2-carboxamide;N-(cyclohexylmethyl)-N-ethyl-1H-indole-2-carboxamide;4,6-dichloro-N-(cyclohexylmethyl)-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2,2-difluoro-2-(3-methylphenyl)ethyl]piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-(2,2-difluoro-2-phenylethyl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-ethyl-N-[[1-[2-(3-ethylphenyl)-2,2-difluoroethyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide
CID 159054548
[4-(5-chloro-1H-indole-2-carbonyl)piperazin-1-yl]-(3-ethynylphenyl)methanone;(5-chloro-1H-indol-2-yl)-[4-[4-(1,1-difluoroethyl)phenoxy]piperidin-1-yl]methanone;(5-chloro-1H-indol-2-yl)-[4-(4-methylphenoxy)piperidin-1-yl]methanone
CID 159055550
1H-indole-2-carbonyl chloride;methane;N-[[1-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]ethanamine;N-[[1-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-N-(2,2,2-trifluoroethyl)-1H-indole-2-carboxamide
CID 159499914
N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
CID 159665508

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide?
The IUPAC name of N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide (CID 160892868) is N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide?
The canonical SMILES for N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide is CN(CC1CCN(Cc2ccccc2Cl)CC1)C(=O)c1cc2ccccc2[nH]1.CN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1cc2ccccc2[nH]1.COc1ccc(CN2CCC(CN(C)C(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1ccccc1CN1CCC(CN(C)C(=O)c2cc3ccccc3[nH]2)CC1.
What is the InChIKey of N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide?
The InChIKey is SOMQBZJZXONLFP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C24H29N3O2.C23H26ClN3O.C23H26FN3O/c1-26(24(28)22-15-19-7-3-5-9-21(19)25-22)16-18-11-13-27(14-12-18)17-20-8-4-6-10-23(20)29-2;1-26(24(28)23-15-20-5-3-4-6-22(20)25-23)16-19-11-13-27(14-12-19)17-18-7-9-21(29-2)10-8-18;2*1-26(23(28)22-14-18-6-3-5-9-21(18)25-22)15-17-10-12-27(13-11-17)16-19-7-2-4-8-20(19)24/h3-10,15,18,25H,11-14,16-17H2,1-2H3;3-10,15,19,25H,11-14,16-17H2,1-2H3;2*2-9,14,17,25H,10-13,15-16H2,1H3.
What are the key properties of N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide?
N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide has a molecular weight of 1558.44 g/mol, XLogP of 17.42, 22 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide;N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]-N-methyl-1H-indole-2-carboxamide is sourced from PubChem (CID 160892868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).