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

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Related Compounds

4-(chloromethyl)-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 55082146
N-[1-(hydroxymethyl)cyclohexyl]thiophene-3-carboxamide
CID 62520743
1-N-[1-(hydroxymethyl)cyclopentyl]-4-N,4-N-dimethylbenzene-1,4-dicarboxamide
CID 110008768
3,4,5-trifluoro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 63186841
N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 62517382
3-amino-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 55081511
N-[1-(hydroxymethyl)cyclopentyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 62518437
N-[1-(hydroxymethyl)cyclopentyl]-1H-pyrrole-3-sulfonamide
CID 62519994
N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 55082531
4-acetyl-N-[1-(hydroxymethyl)cyclohexyl]-1H-pyrrole-2-carboxamide
CID 62521821
3,4,5-trifluoro-N-[1-(hydroxymethyl)cyclohexyl]benzamide
CID 63186883
2,6-dichloro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 62519426

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).