1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide

C15H18N4O2 — CID 63117509

IUPAC1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)c2cc3cccc(N)c3[nH]2)C1
InChIInChI=1S/C15H18N4O2/c16-11-5-1-3-9-7-12(18-13(9)11)15(21)19-6-2-4-10(8-19)14(17)20/h1,3,5,7,10,18H,2,4,6,8,16H2,(H2,17,20)
InChIKeyGAVIHMSENHTXEI-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.09
Rot. Bonds2

About 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide

1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide (PubChem CID 63117509) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide
PubChem CID63117509
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)c2cc3cccc(N)c3[nH]2)C1
InChIInChI=1S/C15H18N4O2/c16-11-5-1-3-9-7-12(18-13(9)11)15(21)19-6-2-4-10(8-19)14(17)20/h1,3,5,7,10,18H,2,4,6,8,16H2,(H2,17,20)
InChIKeyGAVIHMSENHTXEI-UHFFFAOYSA-N
XLogP1.09
TPSA105.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(7-amino-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone
CID 63117526
(7-amino-1H-indol-2-yl)-(3-ethoxypiperidin-1-yl)methanone
CID 63118076
(7-amino-1H-indol-2-yl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 106585611
(7-amino-1H-indol-2-yl)-(4-methylpiperidin-1-yl)methanone
CID 62058735
4-(7-amino-1H-indole-2-carbonyl)piperazin-2-one
CID 63117488
(7-amino-1H-indol-2-yl)-(3-hydroxy-3-propan-2-ylazetidin-1-yl)methanone
CID 107210797
4-(7-amino-1H-indole-2-carbonyl)-1-methylpiperazin-2-one
CID 64682976
(7-amino-1H-indol-2-yl)-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 63764630
1-(6-butoxy-1H-indole-2-carbonyl)piperidine-3-carboxamide
CID 71895157
1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide
CID 103891600
ethyl (3S)-1-(1H-indole-2-carbonyl)piperidine-3-carboxylate
CID 29206160
1-(4-amino-3-fluorobenzoyl)piperidine-3-carboxamide
CID 62678681

Frequently Asked Questions

What is the IUPAC name of 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide?
The IUPAC name of 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide (CID 63117509) is 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide is NC(=O)C1CCCN(C(=O)c2cc3cccc(N)c3[nH]2)C1.
What is the InChIKey of 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide?
The InChIKey is GAVIHMSENHTXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c16-11-5-1-3-9-7-12(18-13(9)11)15(21)19-6-2-4-10(8-19)14(17)20/h1,3,5,7,10,18H,2,4,6,8,16H2,(H2,17,20).
What are the key properties of 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide?
1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 1.09, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-amino-1H-indole-2-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 63117509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).