N-(1H-indol-3-yl)pyrrolidine-1-carboxamide

C13H15N3O — CID 7615879

IUPACN-(1H-indol-3-yl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1c[nH]c2ccccc12)N1CCCC1
InChIInChI=1S/C13H15N3O/c17-13(16-7-3-4-8-16)15-12-9-14-11-6-2-1-5-10(11)12/h1-2,5-6,9,14H,3-4,7-8H2,(H,15,17)
InChIKeyOVGVGYIVMOSZCP-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.80
Rot. Bonds1

About N-(1H-indol-3-yl)pyrrolidine-1-carboxamide

N-(1H-indol-3-yl)pyrrolidine-1-carboxamide (PubChem CID 7615879) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is N-(1H-indol-3-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1H-indol-3-yl)pyrrolidine-1-carboxamide
PubChem CID7615879
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC NameN-(1H-indol-3-yl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1c[nH]c2ccccc12)N1CCCC1
InChIInChI=1S/C13H15N3O/c17-13(16-7-3-4-8-16)15-12-9-14-11-6-2-1-5-10(11)12/h1-2,5-6,9,14H,3-4,7-8H2,(H,15,17)
InChIKeyOVGVGYIVMOSZCP-UHFFFAOYSA-N
XLogP2.80
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze N-(1H-indol-3-yl)pyrrolidine-1-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

N-(1H-indol-3-yl)-4-methylpiperazine-1-carboxamide
CID 7615909
N-(1H-indol-3-yl)-4-phenylpiperazine-1-carboxamide
CID 7595792
4-(2-hydroxyethyl)-N-(1H-indol-3-yl)piperazin-4-ium-1-carboxamide
CID 7615912
4-(3-chlorophenyl)-N-(1H-indol-3-yl)piperazine-1-carboxamide
CID 7595794
(2S,6S)-N-(1H-indol-3-yl)-2,6-dimethylpiperidine-1-carboxamide
CID 7615898
1H-indol-3-ylcarbamic acid
CID 66672709
N-(8-methyl-4-oxo-1H-quinolin-3-yl)pyrrolidine-1-carboxamide
CID 6484351
2-chloro-N-(1H-indol-3-yl)benzamide
CID 56763159
N-[2-(hydroxymethyl)phenyl]pyrrolidine-1-carboxamide
CID 79161334
N-(2-methylphenyl)azepane-1-carboxamide
CID 19165583
1H-indol-3-yl(pyrrolidin-1-yl)methanethione
CID 750123
N-(1H-indol-3-yl)butanamide;dihydrochloride
CID 142898662

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-3-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(1H-indol-3-yl)pyrrolidine-1-carboxamide (CID 7615879) is N-(1H-indol-3-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1H-indol-3-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1H-indol-3-yl)pyrrolidine-1-carboxamide is O=C(Nc1c[nH]c2ccccc12)N1CCCC1.
What is the InChIKey of N-(1H-indol-3-yl)pyrrolidine-1-carboxamide?
The InChIKey is OVGVGYIVMOSZCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c17-13(16-7-3-4-8-16)15-12-9-14-11-6-2-1-5-10(11)12/h1-2,5-6,9,14H,3-4,7-8H2,(H,15,17).
What are the key properties of N-(1H-indol-3-yl)pyrrolidine-1-carboxamide?
N-(1H-indol-3-yl)pyrrolidine-1-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 2.80, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-3-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 7615879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).