N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide

C15H15N3O — CID 55153670

IUPACN-(2-cyanocyclopentyl)-1H-indole-4-carboxamide
SMILESN#CC1CCCC1NC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C15H15N3O/c16-9-10-3-1-5-13(10)18-15(19)12-4-2-6-14-11(12)7-8-17-14/h2,4,6-8,10,13,17H,1,3,5H2,(H,18,19)
InChIKeyXVZXTWQWGJKPMI-UHFFFAOYSA-N
MW253.30 g/mol
LogP2.59
Rot. Bonds2

About N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide

N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide (PubChem CID 55153670) has the molecular formula C15H15N3O and a molecular weight of 253.30 g/mol. Its IUPAC name is N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-(2-cyanocyclopentyl)-1H-indole-4-carboxamide
PubChem CID55153670
Molecular FormulaC15H15N3O
Molecular Weight253.30 g/mol
Exact Mass253.12
IUPAC NameN-(2-cyanocyclopentyl)-1H-indole-4-carboxamide
SMILESN#CC1CCCC1NC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C15H15N3O/c16-9-10-3-1-5-13(10)18-15(19)12-4-2-6-14-11(12)7-8-17-14/h2,4,6-8,10,13,17H,1,3,5H2,(H,18,19)
InChIKeyXVZXTWQWGJKPMI-UHFFFAOYSA-N
XLogP2.59
TPSA68.68 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide?
The IUPAC name of N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide (CID 55153670) is N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide.
What is the SMILES notation for N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide?
The canonical SMILES for N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide is N#CC1CCCC1NC(=O)c1cccc2[nH]ccc12.
What is the InChIKey of N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide?
The InChIKey is XVZXTWQWGJKPMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c16-9-10-3-1-5-13(10)18-15(19)12-4-2-6-14-11(12)7-8-17-14/h2,4,6-8,10,13,17H,1,3,5H2,(H,18,19).
What are the key properties of N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide?
N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide has a molecular weight of 253.30 g/mol, XLogP of 2.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanocyclopentyl)-1H-indole-4-carboxamide is sourced from PubChem (CID 55153670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).