2-(cyclohexen-1-yl)-1H-indole-5-carboxamide

C15H16N2O — CID 11230198

IUPAC2-(cyclohexen-1-yl)-1H-indole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]c(C3=CCCCC3)cc2c1
InChIInChI=1S/C15H16N2O/c16-15(18)11-6-7-13-12(8-11)9-14(17-13)10-4-2-1-3-5-10/h4,6-9,17H,1-3,5H2,(H2,16,18)
InChIKeyQBTRSPFCTGPWIA-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.22
Rot. Bonds2

About 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide

2-(cyclohexen-1-yl)-1H-indole-5-carboxamide (PubChem CID 11230198) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-1H-indole-5-carboxamide
PubChem CID11230198
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2-(cyclohexen-1-yl)-1H-indole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]c(C3=CCCCC3)cc2c1
InChIInChI=1S/C15H16N2O/c16-15(18)11-6-7-13-12(8-11)9-14(17-13)10-4-2-1-3-5-10/h4,6-9,17H,1-3,5H2,(H2,16,18)
InChIKeyQBTRSPFCTGPWIA-UHFFFAOYSA-N
XLogP3.22
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide?
The IUPAC name of 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide (CID 11230198) is 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide.
What is the SMILES notation for 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide?
The canonical SMILES for 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide is NC(=O)c1ccc2[nH]c(C3=CCCCC3)cc2c1.
What is the InChIKey of 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide?
The InChIKey is QBTRSPFCTGPWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c16-15(18)11-6-7-13-12(8-11)9-14(17-13)10-4-2-1-3-5-10/h4,6-9,17H,1-3,5H2,(H2,16,18).
What are the key properties of 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide?
2-(cyclohexen-1-yl)-1H-indole-5-carboxamide has a molecular weight of 240.31 g/mol, XLogP of 3.22, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)-1H-indole-5-carboxamide is sourced from PubChem (CID 11230198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).