3-ethenyl-N-methylcyclopentane-1-carboxamide

C9H15NO — CID 169181911

IUPAC3-ethenyl-N-methylcyclopentane-1-carboxamide
SMILESC=CC1CCC(C(=O)NC)C1
InChIInChI=1S/C9H15NO/c1-3-7-4-5-8(6-7)9(11)10-2/h3,7-8H,1,4-6H2,2H3,(H,10,11)
InChIKeyKJBCCRRERMBNOB-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.33
Rot. Bonds2

About 3-ethenyl-N-methylcyclopentane-1-carboxamide

3-ethenyl-N-methylcyclopentane-1-carboxamide (PubChem CID 169181911) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 3-ethenyl-N-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-ethenyl-N-methylcyclopentane-1-carboxamide
PubChem CID169181911
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name3-ethenyl-N-methylcyclopentane-1-carboxamide
SMILESC=CC1CCC(C(=O)NC)C1
InChIInChI=1S/C9H15NO/c1-3-7-4-5-8(6-7)9(11)10-2/h3,7-8H,1,4-6H2,2H3,(H,10,11)
InChIKeyKJBCCRRERMBNOB-UHFFFAOYSA-N
XLogP1.33
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

cis-(1R,3S)-3-ethenylcyclopentane-1-carboxylic acid
CID 11240528
methyl 3-ethenylcyclohexane-1-carboxylate
CID 142059181
4-ethenylcyclohexane-1-carboxylic acid
CID 18538169
4-N-methylcyclohexane-1,4-dicarboxamide
CID 131039944
(3S)-3-(methylcarbamoyl)cyclohexane-1-carboxylic acid
CID 54034306
N-methyl-4-[2-(methylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 155198720
N,4-dimethylcyclohexane-1-carboxamide;ethane;methanamine
CID 145422265
N-methyl-4-propanoylcyclohexane-1-carboxamide
CID 170174898
3-fluoro-N-methylcyclobutane-1-carboxamide
CID 144873088
CID 89404179
CID 89404179
1-(cyclopropanecarbonyl)-N-methylpiperidine-4-carboxamide
CID 60637060
N-methylspiro[2.5]octane-6-carboxamide
CID 59578553

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-N-methylcyclopentane-1-carboxamide?
The IUPAC name of 3-ethenyl-N-methylcyclopentane-1-carboxamide (CID 169181911) is 3-ethenyl-N-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 3-ethenyl-N-methylcyclopentane-1-carboxamide?
The canonical SMILES for 3-ethenyl-N-methylcyclopentane-1-carboxamide is C=CC1CCC(C(=O)NC)C1.
What is the InChIKey of 3-ethenyl-N-methylcyclopentane-1-carboxamide?
The InChIKey is KJBCCRRERMBNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-3-7-4-5-8(6-7)9(11)10-2/h3,7-8H,1,4-6H2,2H3,(H,10,11).
What are the key properties of 3-ethenyl-N-methylcyclopentane-1-carboxamide?
3-ethenyl-N-methylcyclopentane-1-carboxamide has a molecular weight of 153.22 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-N-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 169181911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).