(3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide

C23H24N4O3 — CID 41087933

IUPAC(3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)cc1
InChIInChI=1S/C23H24N4O3/c1-15(28)25-19-5-7-20(8-6-19)26-22(29)18-3-2-12-27(14-18)23(30)17-4-9-21-16(13-17)10-11-24-21/h4-11,13,18,24H,2-3,12,14H2,1H3,(H,25,28)(H,26,29)/t18-/m1/s1
InChIKeyBVZWXEKXURIVGB-GOSISDBHSA-N
MW404.47 g/mol
LogP3.62
Rot. Bonds4

About (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide

(3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide (PubChem CID 41087933) has the molecular formula C23H24N4O3 and a molecular weight of 404.47 g/mol. Its IUPAC name is (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide
PubChem CID41087933
Molecular FormulaC23H24N4O3
Molecular Weight404.47 g/mol
Exact Mass404.18
IUPAC Name(3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)cc1
InChIInChI=1S/C23H24N4O3/c1-15(28)25-19-5-7-20(8-6-19)26-22(29)18-3-2-12-27(14-18)23(30)17-4-9-21-16(13-17)10-11-24-21/h4-11,13,18,24H,2-3,12,14H2,1H3,(H,25,28)(H,26,29)/t18-/m1/s1
InChIKeyBVZWXEKXURIVGB-GOSISDBHSA-N
XLogP3.62
TPSA94.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide
CID 42650295
(3S)-N-(3,5-dimethoxyphenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide
CID 41129492
(3S)-N-(4-acetamidophenyl)-1-(3,5-dimethylbenzoyl)piperidine-3-carboxamide
CID 94082860
(3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide
CID 41091330
N-[(3,4-dichlorophenyl)methyl]-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide
CID 42650272
1-(3-acetamidobenzoyl)-N-(4-chlorophenyl)piperidine-3-carboxamide
CID 71681887
1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide
CID 110744988
N-(3-acetamidophenyl)-1-(1H-indole-2-carbonyl)piperidine-3-carboxamide
CID 42649922
N-(4-methoxyphenyl)-1-(4-methylbenzoyl)piperidine-3-carboxamide
CID 55623806
(3S)-1-(4-acetamidobenzoyl)-N-prop-2-enylpiperidine-3-carboxamide
CID 92728970
N-[4-(carbamoylamino)phenyl]-1-(4-methylbenzoyl)piperidine-3-carboxamide
CID 55627027
N-(4-iodophenyl)-1-(4-methylbenzoyl)piperidine-3-carboxamide
CID 55624039

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide (CID 41087933) is (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide is CC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)cc1.
What is the InChIKey of (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide?
The InChIKey is BVZWXEKXURIVGB-GOSISDBHSA-N. The full InChI is InChI=1S/C23H24N4O3/c1-15(28)25-19-5-7-20(8-6-19)26-22(29)18-3-2-12-27(14-18)23(30)17-4-9-21-16(13-17)10-11-24-21/h4-11,13,18,24H,2-3,12,14H2,1H3,(H,25,28)(H,26,29)/t18-/m1/s1.
What are the key properties of (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide?
(3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide has a molecular weight of 404.47 g/mol, XLogP of 3.62, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 41087933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).