2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid

C10H14N2O3 — CID 61011951

IUPAC2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid
SMILESCCCN(CC(=O)O)C(=O)c1ccc[nH]1
InChIInChI=1S/C10H14N2O3/c1-2-6-12(7-9(13)14)10(15)8-4-3-5-11-8/h3-5,11H,2,6-7H2,1H3,(H,13,14)
InChIKeyMSGMPIMAMNRSLO-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.95
Rot. Bonds5

About 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid

2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid (PubChem CID 61011951) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid
PubChem CID61011951
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid
SMILESCCCN(CC(=O)O)C(=O)c1ccc[nH]1
InChIInChI=1S/C10H14N2O3/c1-2-6-12(7-9(13)14)10(15)8-4-3-5-11-8/h3-5,11H,2,6-7H2,1H3,(H,13,14)
InChIKeyMSGMPIMAMNRSLO-UHFFFAOYSA-N
XLogP0.95
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid 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-[(2-oxo-1H-pyridine-3-carbonyl)-propylamino]acetic acid
CID 54898998
2-[benzoyl(propyl)amino]acetic acid
CID 61011930
2-[(2,6-difluorobenzoyl)-propylamino]acetic acid
CID 61011405
2-(dipropylamino)-1-(1H-pyrrol-2-yl)ethanone
CID 43219598
2-[(2-bromobenzoyl)-propylamino]acetic acid
CID 61011660
2-[(5-fluoro-1H-indole-2-carbonyl)-propylamino]acetic acid
CID 119205230
2-[(2-chloro-6-fluorobenzoyl)-propylamino]acetic acid
CID 61011677
N-benzyl-N-(2-hydroxyethyl)-1H-pyrrole-2-carboxamide
CID 60682006
2-[(2-iodo-3-methylbenzoyl)-propylamino]acetic acid
CID 113263220
2-[(4-tert-butylbenzoyl)-propylamino]acetic acid
CID 61011522
2-[(2-methyl-1H-indole-3-carbonyl)-propylamino]acetic acid
CID 61007359
N-(1-hydroxypropan-2-yl)-N-methyl-1H-pyrrole-2-carboxamide
CID 115765120

Frequently Asked Questions

What is the IUPAC name of 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid?
The IUPAC name of 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid (CID 61011951) is 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid is CCCN(CC(=O)O)C(=O)c1ccc[nH]1.
What is the InChIKey of 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid?
The InChIKey is MSGMPIMAMNRSLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-2-6-12(7-9(13)14)10(15)8-4-3-5-11-8/h3-5,11H,2,6-7H2,1H3,(H,13,14).
What are the key properties of 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid?
2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid has a molecular weight of 210.23 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[propyl(1H-pyrrole-2-carbonyl)amino]acetic acid is sourced from PubChem (CID 61011951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).