N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide

C10H15NO2 — CID 115764739

IUPACN-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide
SMILESO=C(NC1(CO)CC1)C1CC=CC1
InChIInChI=1S/C10H15NO2/c12-7-10(5-6-10)11-9(13)8-3-1-2-4-8/h1-2,8,12H,3-7H2,(H,11,13)
InChIKeyAENMKJPXZOLBMI-UHFFFAOYSA-N
MW181.23 g/mol
LogP0.59
Rot. Bonds3

About N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide

N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide (PubChem CID 115764739) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide
PubChem CID115764739
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide
SMILESO=C(NC1(CO)CC1)C1CC=CC1
InChIInChI=1S/C10H15NO2/c12-7-10(5-6-10)11-9(13)8-3-1-2-4-8/h1-2,8,12H,3-7H2,(H,11,13)
InChIKeyAENMKJPXZOLBMI-UHFFFAOYSA-N
XLogP0.59
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[1-(hydroxymethyl)cyclopropyl]cycloheptanecarboxamide
CID 115764905
N-[1-(hydroxymethyl)cyclobutyl]cyclopropanecarboxamide
CID 115878461
N-[1-(hydroxymethyl)cyclobutyl]cycloheptanecarboxamide
CID 115878103
(1S,6R)-6-[[1-(hydroxymethyl)-4-methylcyclohexyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 104962384
N-[1-(hydroxymethyl)-4-methylcyclohexyl]cyclopropanecarboxamide
CID 62525414
N-[1-(hydroxymethyl)cyclopropyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 115877696
N-[1-(hydroxymethyl)cyclopropyl]-1-methylsulfonylpiperidine-4-carboxamide
CID 115764707
N-[1-(hydroxymethyl)cyclohexyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106893203
N-[4-(hydroxymethyl)oxan-4-yl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106704048
4-amino-N-[4-(hydroxymethyl)oxan-4-yl]cyclohexane-1-carboxamide
CID 106298573
N-[1-(hydroxymethyl)cyclohexyl]pyrrolidine-3-carboxamide
CID 63006732
1-acetyl-N-[1-(hydroxymethyl)cyclohexyl]piperidine-4-carboxamide
CID 62520575

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide (CID 115764739) is N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide is O=C(NC1(CO)CC1)C1CC=CC1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide?
The InChIKey is AENMKJPXZOLBMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c12-7-10(5-6-10)11-9(13)8-3-1-2-4-8/h1-2,8,12H,3-7H2,(H,11,13).
What are the key properties of N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide?
N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide has a molecular weight of 181.23 g/mol, XLogP of 0.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopropyl]cyclopent-3-ene-1-carboxamide is sourced from PubChem (CID 115764739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).