2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide

C21H24N4O — CID 155947044

IUPAC2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1cccnc1N1CCC(c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/C21H24N4O/c1-24(2)21(26)17-7-5-11-22-20(17)25-12-9-15(10-13-25)19-14-16-6-3-4-8-18(16)23-19/h3-8,11,14-15,23H,9-10,12-13H2,1-2H3
InChIKeyGOXWNNBLRIQOSN-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.65
Rot. Bonds3

About 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide

2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 155947044) has the molecular formula C21H24N4O and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
PubChem CID155947044
Molecular FormulaC21H24N4O
Molecular Weight348.45 g/mol
Exact Mass348.20
IUPAC Name2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1cccnc1N1CCC(c2cc3ccccc3[nH]2)CC1
InChIInChI=1S/C21H24N4O/c1-24(2)21(26)17-7-5-11-22-20(17)25-12-9-15(10-13-25)19-14-16-6-3-4-8-18(16)23-19/h3-8,11,14-15,23H,9-10,12-13H2,1-2H3
InChIKeyGOXWNNBLRIQOSN-UHFFFAOYSA-N
XLogP3.65
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(dimethylamino)-4-pyridinyl]-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 51097128
N,N-dimethyl-2-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
CID 3040781
2-[4-[4-(3-fluorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
CID 56742491
1-[4-(1H-indol-2-yl)piperidin-1-yl]-3-(pyrimidin-2-ylamino)propan-1-one
CID 51097129
N-methyl-N-[1-[3-(propan-2-ylamino)-2-pyridinyl]pyrrolidin-3-yl]-1H-indole-2-carboxamide
CID 15953892
3-[[4-(1H-indol-2-yl)piperidin-1-yl]sulfonyl-methylamino]propanoic acid
CID 166239289
(2-hydroxy-4-methylphenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 139011392
(4-fluorophenyl)-[4-(1H-indol-2-yl)piperidin-1-yl]methanone
CID 113087831
2-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-N,N-dimethylpyridine-3-carboxamide
CID 164690007
N-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-2-yl)piperidine-1-carboxamide
CID 165433207
N-cyclopropyl-2-[4-(1H-indol-2-yl)piperidin-1-yl]propanamide
CID 51097283
[3-(1H-indol-2-yl)pyrrolidin-1-yl]-pyridin-3-ylmethanone
CID 113088338

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide (CID 155947044) is 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide is CN(C)C(=O)c1cccnc1N1CCC(c2cc3ccccc3[nH]2)CC1.
What is the InChIKey of 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is GOXWNNBLRIQOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O/c1-24(2)21(26)17-7-5-11-22-20(17)25-12-9-15(10-13-25)19-14-16-6-3-4-8-18(16)23-19/h3-8,11,14-15,23H,9-10,12-13H2,1-2H3.
What are the key properties of 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide?
2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 348.45 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1H-indol-2-yl)piperidin-1-yl]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 155947044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).