3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide

C23H27N5O2 — CID 167986441

IUPAC3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide
SMILESCc1ncc2n1CCC(C(=O)N1CCC(c3c[nH]c4ccc(C(N)=O)cc34)CC1)C2
InChIInChI=1S/C23H27N5O2/c1-14-25-12-18-10-17(6-9-28(14)18)23(30)27-7-4-15(5-8-27)20-13-26-21-3-2-16(22(24)29)11-19(20)21/h2-3,11-13,15,17,26H,4-10H2,1H3,(H2,24,29)
InChIKeyRGVNEYNUBOBTQV-UHFFFAOYSA-N
MW405.50 g/mol
LogP2.74
Rot. Bonds3

About 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide

3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide (PubChem CID 167986441) has the molecular formula C23H27N5O2 and a molecular weight of 405.50 g/mol. Its IUPAC name is 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide.

Molecular Properties

Compound Name3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide
PubChem CID167986441
Molecular FormulaC23H27N5O2
Molecular Weight405.50 g/mol
Exact Mass405.22
IUPAC Name3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide
SMILESCc1ncc2n1CCC(C(=O)N1CCC(c3c[nH]c4ccc(C(N)=O)cc34)CC1)C2
InChIInChI=1S/C23H27N5O2/c1-14-25-12-18-10-17(6-9-28(14)18)23(30)27-7-4-15(5-8-27)20-13-26-21-3-2-16(22(24)29)11-19(20)21/h2-3,11-13,15,17,26H,4-10H2,1H3,(H2,24,29)
InChIKeyRGVNEYNUBOBTQV-UHFFFAOYSA-N
XLogP2.74
TPSA97.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide with MolForge

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Related Compounds

3-(1-methylpiperidin-4-yl)-1H-indole-5-carboxamide
CID 19987271
3-[1-[(2S)-1-oxo-1-(pyrimidin-2-ylamino)propan-2-yl]piperidin-4-yl]-1H-indole-5-carboxamide
CID 97261045
3-[1-[(E)-3-quinolin-8-ylprop-2-enoyl]piperidin-4-yl]-1H-indole-5-carboxamide
CID 166214351
cyclobutyl-[4-(5-fluoro-1H-indol-3-yl)piperidin-1-yl]methanone
CID 113087422
(4-hydroxycyclohexyl)-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methanone
CID 126767282
3-[1-[(E)-3-(5-chloro-2-methoxyphenyl)prop-2-enoyl]piperidin-4-yl]-1H-indole-5-carboxamide
CID 75450677
cyclohexyl-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]methanone
CID 113087522
3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxylic acid
CID 83636150
N-[3-[1-(cyclopentanecarbonyl)piperidin-4-yl]-1H-indol-5-yl]-3H-benzimidazole-5-carboxamide
CID 118865652
(3,4-dimethoxyphenyl)-[4-(5-fluoro-1H-indol-3-yl)piperidin-1-yl]methanone
CID 113087390
[4-(1H-indol-3-yl)piperidin-1-yl]-[(2S,4S)-2-methylpiperidin-4-yl]methanone
CID 120631960
tert-butyl 4-(5-fluoro-1H-indol-3-yl)piperidine-1-carboxylate
CID 22714417

Frequently Asked Questions

What is the IUPAC name of 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide?
The IUPAC name of 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide (CID 167986441) is 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide.
What is the SMILES notation for 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide?
The canonical SMILES for 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide is Cc1ncc2n1CCC(C(=O)N1CCC(c3c[nH]c4ccc(C(N)=O)cc34)CC1)C2.
What is the InChIKey of 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide?
The InChIKey is RGVNEYNUBOBTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O2/c1-14-25-12-18-10-17(6-9-28(14)18)23(30)27-7-4-15(5-8-27)20-13-26-21-3-2-16(22(24)29)11-19(20)21/h2-3,11-13,15,17,26H,4-10H2,1H3,(H2,24,29).
What are the key properties of 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide?
3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide has a molecular weight of 405.50 g/mol, XLogP of 2.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carbonyl)piperidin-4-yl]-1H-indole-5-carboxamide is sourced from PubChem (CID 167986441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).