N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide

C14H17N3O2 — CID 76893355

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide
SMILESO=C(CNC(=O)C1Cc2ccccc2N1)NC1CC1
InChIInChI=1S/C14H17N3O2/c18-13(16-10-5-6-10)8-15-14(19)12-7-9-3-1-2-4-11(9)17-12/h1-4,10,12,17H,5-8H2,(H,15,19)(H,16,18)
InChIKeyKMYYFTMFJBLZTK-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.42
Rot. Bonds4

About N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide

N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 76893355) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID76893355
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide
SMILESO=C(CNC(=O)C1Cc2ccccc2N1)NC1CC1
InChIInChI=1S/C14H17N3O2/c18-13(16-10-5-6-10)8-15-14(19)12-7-9-3-1-2-4-11(9)17-12/h1-4,10,12,17H,5-8H2,(H,15,19)(H,16,18)
InChIKeyKMYYFTMFJBLZTK-UHFFFAOYSA-N
XLogP0.42
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide 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

(2S)-N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61147921
3-(2,3-dihydro-1H-indole-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 77110035
3-[[(2S)-2,3-dihydro-1H-indole-2-carbonyl]amino]propanoic acid
CID 61157648
N-hydroxy-2,3-dihydro-1H-indole-2-carboxamide
CID 77014605
(2S)-N-(2,3-dimethylbutyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 64599096
N-(4-hydroxybutyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 106842127
3-[[(2S)-2,3-dihydro-1H-indole-2-carbonyl]amino]-2-hydroxypropanoic acid
CID 66167597
3-(2,3-dihydro-1H-indole-2-carbonylamino)-2-methylpropanoic acid
CID 54462725
(2S)-N-pentyl-2,3-dihydro-1H-indole-2-carboxamide
CID 61148939
(2S)-N-(1-ethylpiperidin-4-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61156890
(2S)-N-[(2-bromophenyl)methyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 61402453
(2S)-N-[(4-chlorophenyl)methyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 61148810

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide (CID 76893355) is N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide is O=C(CNC(=O)C1Cc2ccccc2N1)NC1CC1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is KMYYFTMFJBLZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c18-13(16-10-5-6-10)8-15-14(19)12-7-9-3-1-2-4-11(9)17-12/h1-4,10,12,17H,5-8H2,(H,15,19)(H,16,18).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide?
N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 0.42, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 76893355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).