N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide

C11H16N2O2 — CID 110008429

IUPACN-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide
SMILESO=C(NC1(CO)CCCC1)c1cc[nH]c1
InChIInChI=1S/C11H16N2O2/c14-8-11(4-1-2-5-11)13-10(15)9-3-6-12-7-9/h3,6-7,12,14H,1-2,4-5,8H2,(H,13,15)
InChIKeyLYGWWSMBSVILOH-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.05
Rot. Bonds3

About N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide

N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide (PubChem CID 110008429) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide
PubChem CID110008429
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide
SMILESO=C(NC1(CO)CCCC1)c1cc[nH]c1
InChIInChI=1S/C11H16N2O2/c14-8-11(4-1-2-5-11)13-10(15)9-3-6-12-7-9/h3,6-7,12,14H,1-2,4-5,8H2,(H,13,15)
InChIKeyLYGWWSMBSVILOH-UHFFFAOYSA-N
XLogP1.05
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide (CID 110008429) is N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide is O=C(NC1(CO)CCCC1)c1cc[nH]c1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide?
The InChIKey is LYGWWSMBSVILOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c14-8-11(4-1-2-5-11)13-10(15)9-3-6-12-7-9/h3,6-7,12,14H,1-2,4-5,8H2,(H,13,15).
What are the key properties of N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide?
N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 1.05, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-carboxamide is sourced from PubChem (CID 110008429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).