azane;1H-indole-7-carboxamide

C9H11N3O — CID 174982702

IUPACazane;1H-indole-7-carboxamide
SMILESN.NC(=O)c1cccc2cc[nH]c12
InChIInChI=1S/C9H8N2O.H3N/c10-9(12)7-3-1-2-6-4-5-11-8(6)7;/h1-5,11H,(H2,10,12);1H3
InChIKeyBPMFBPOJYQWPQX-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.43
Rot. Bonds1

About azane;1H-indole-7-carboxamide

azane;1H-indole-7-carboxamide (PubChem CID 174982702) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is azane;1H-indole-7-carboxamide.

Molecular Properties

Compound Nameazane;1H-indole-7-carboxamide
PubChem CID174982702
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Nameazane;1H-indole-7-carboxamide
SMILESN.NC(=O)c1cccc2cc[nH]c12
InChIInChI=1S/C9H8N2O.H3N/c10-9(12)7-3-1-2-6-4-5-11-8(6)7;/h1-5,11H,(H2,10,12);1H3
InChIKeyBPMFBPOJYQWPQX-UHFFFAOYSA-N
XLogP1.43
TPSA93.88 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1H-indole-7-carboxylic acid;hydrochloride
CID 67635723
sodium 1H-indole-7-carbonylazanide
CID 158877903
methyl 1H-indole-7-carboxylate;hydrochloride
CID 175318571
7-chloro-1H-indole-6-carboxamide
CID 162383252
1H-pyrrolo[3,2-c]pyridine-7-carboxamide
CID 67034068
N-carbamimidoyl-N-methyl-1H-indole-7-carboxamide;hydrochloride
CID 70218079
N-(6-carbamoyl-3-pyridinyl)-1H-indole-7-carboxamide
CID 75396193
2-amino-3-hydroxybenzoic acid;1H-indol-7-ol
CID 67779997
1H-indol-7-yl-(4-methoxyphenyl)methanone
CID 141393759
5-(4-phenylphenyl)-1H-indole-7-carboxamide
CID 11174416
(3,4-dihydroxypyrrolidin-1-yl)-(1H-indol-7-yl)methanone
CID 106671264
(3-bromophenyl)-(1H-indol-7-yl)methanone
CID 175674927

Frequently Asked Questions

What is the IUPAC name of azane;1H-indole-7-carboxamide?
The IUPAC name of azane;1H-indole-7-carboxamide (CID 174982702) is azane;1H-indole-7-carboxamide.
What is the SMILES notation for azane;1H-indole-7-carboxamide?
The canonical SMILES for azane;1H-indole-7-carboxamide is N.NC(=O)c1cccc2cc[nH]c12.
What is the InChIKey of azane;1H-indole-7-carboxamide?
The InChIKey is BPMFBPOJYQWPQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O.H3N/c10-9(12)7-3-1-2-6-4-5-11-8(6)7;/h1-5,11H,(H2,10,12);1H3.
What are the key properties of azane;1H-indole-7-carboxamide?
azane;1H-indole-7-carboxamide has a molecular weight of 177.21 g/mol, XLogP of 1.43, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1H-indole-7-carboxamide is sourced from PubChem (CID 174982702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).