4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide

C11H15BrN2O2 — CID 103774215

IUPAC4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide
SMILESO=C(NC1CCCC1CO)c1cc(Br)c[nH]1
InChIInChI=1S/C11H15BrN2O2/c12-8-4-10(13-5-8)11(16)14-9-3-1-2-7(9)6-15/h4-5,7,9,13,15H,1-3,6H2,(H,14,16)
InChIKeyNOPGIAYENBBPBM-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.67
Rot. Bonds3

About 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide

4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide (PubChem CID 103774215) has the molecular formula C11H15BrN2O2 and a molecular weight of 287.16 g/mol. Its IUPAC name is 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide
PubChem CID103774215
Molecular FormulaC11H15BrN2O2
Molecular Weight287.16 g/mol
Exact Mass286.03
IUPAC Name4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide
SMILESO=C(NC1CCCC1CO)c1cc(Br)c[nH]1
InChIInChI=1S/C11H15BrN2O2/c12-8-4-10(13-5-8)11(16)14-9-3-1-2-7(9)6-15/h4-5,7,9,13,15H,1-3,6H2,(H,14,16)
InChIKeyNOPGIAYENBBPBM-UHFFFAOYSA-N
XLogP1.67
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-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

3,5-dibromo-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103909256
3-bromo-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 103798593
5-bromo-2-chloro-N-[2-(hydroxymethyl)cyclopentyl]pyridine-3-carboxamide
CID 103774144
4-bromo-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-1H-pyrrole-2-carboxamide
CID 65470309
4,5-dibromo-N-[2-(hydroxymethyl)cyclohexyl]thiophene-2-carboxamide
CID 103860399
N-[2-(hydroxymethyl)cyclopentyl]-1H-indole-3-carboxamide
CID 103774231
N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide
CID 103751246
N-[2-(hydroxymethyl)cyclohexyl]-3,5-dimethylbenzamide
CID 103798546
4-amino-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 113266858
N-[2-(aminomethyl)cyclopentyl]-5-bromo-6-oxo-1H-pyridine-3-carboxamide;hydrochloride
CID 119604671
N-[2-(hydroxymethyl)cyclopentyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 113259272
N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 85447885

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide?
The IUPAC name of 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide (CID 103774215) is 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide?
The canonical SMILES for 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide is O=C(NC1CCCC1CO)c1cc(Br)c[nH]1.
What is the InChIKey of 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide?
The InChIKey is NOPGIAYENBBPBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O2/c12-8-4-10(13-5-8)11(16)14-9-3-1-2-7(9)6-15/h4-5,7,9,13,15H,1-3,6H2,(H,14,16).
What are the key properties of 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide?
4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide has a molecular weight of 287.16 g/mol, XLogP of 1.67, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-[2-(hydroxymethyl)cyclopentyl]-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 103774215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).