[2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate

C16H18N2O3 — CID 7723573

IUPAC[2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate
SMILESO=C(COC(=O)c1cc2ccccc2[nH]1)NC1CCCC1
InChIInChI=1S/C16H18N2O3/c19-15(17-12-6-2-3-7-12)10-21-16(20)14-9-11-5-1-4-8-13(11)18-14/h1,4-5,8-9,12,18H,2-3,6-7,10H2,(H,17,19)
InChIKeyRKQKWUSBROJNDX-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.38
Rot. Bonds4

About [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate

[2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate (PubChem CID 7723573) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate.

Molecular Properties

Compound Name[2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate
PubChem CID7723573
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name[2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate
SMILESO=C(COC(=O)c1cc2ccccc2[nH]1)NC1CCCC1
InChIInChI=1S/C16H18N2O3/c19-15(17-12-6-2-3-7-12)10-21-16(20)14-9-11-5-1-4-8-13(11)18-14/h1,4-5,8-9,12,18H,2-3,6-7,10H2,(H,17,19)
InChIKeyRKQKWUSBROJNDX-UHFFFAOYSA-N
XLogP2.38
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 1H-indole-2-carboxylate
CID 7722844
[2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl] 1H-indole-2-carboxylate
CID 11906029
[2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxoethyl] 1H-indole-2-carboxylate
CID 7723695
[2-(cyclopentylamino)-2-oxoethyl] anthracene-9-carboxylate
CID 2511548
[2-(2-benzoylhydrazinyl)-2-oxoethyl] 1H-indole-2-carboxylate
CID 7713498
[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 6-methoxy-1H-indole-2-carboxylate
CID 34506263
[2-[[(1S)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] 1H-indole-2-carboxylate
CID 7466136
[2-oxo-2-(2,4,6-trimethylanilino)ethyl] 1H-indole-2-carboxylate
CID 7466205
[2-oxo-2-(pentan-2-ylamino)ethyl] 1H-indole-2-carboxylate
CID 18081770
[(2R)-1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl] 1H-indole-2-carboxylate
CID 7723076
[2-[di(propan-2-yl)amino]-2-oxoethyl] 1H-indole-2-carboxylate
CID 9451057
ethane;ethyl 1H-indole-2-carboxylate
CID 91376411

Frequently Asked Questions

What is the IUPAC name of [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate?
The IUPAC name of [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate (CID 7723573) is [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate.
What is the SMILES notation for [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate?
The canonical SMILES for [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate is O=C(COC(=O)c1cc2ccccc2[nH]1)NC1CCCC1.
What is the InChIKey of [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate?
The InChIKey is RKQKWUSBROJNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c19-15(17-12-6-2-3-7-12)10-21-16(20)14-9-11-5-1-4-8-13(11)18-14/h1,4-5,8-9,12,18H,2-3,6-7,10H2,(H,17,19).
What are the key properties of [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate?
[2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate has a molecular weight of 286.33 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate is sourced from PubChem (CID 7723573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).