N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide

C11H18N2O — CID 164651418

IUPACN-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide
SMILESCNC1CC(C(=O)NC2CC=CC2)C1
InChIInChI=1S/C11H18N2O/c1-12-10-6-8(7-10)11(14)13-9-4-2-3-5-9/h2-3,8-10,12H,4-7H2,1H3,(H,13,14)
InChIKeyBJGGPQOPJGZPST-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.82
Rot. Bonds3

About N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide

N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide (PubChem CID 164651418) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide
PubChem CID164651418
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide
SMILESCNC1CC(C(=O)NC2CC=CC2)C1
InChIInChI=1S/C11H18N2O/c1-12-10-6-8(7-10)11(14)13-9-4-2-3-5-9/h2-3,8-10,12H,4-7H2,1H3,(H,13,14)
InChIKeyBJGGPQOPJGZPST-UHFFFAOYSA-N
XLogP0.82
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.82
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-cyclopent-3-en-1-ylcyclopropanecarboxamide
CID 115696635
1-cyclopent-3-en-1-yl-3-methylurea
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4-(aminomethyl)-N-cyclopent-3-en-1-ylcyclohexane-1-carboxamide
CID 104694630
N-methylcyclopent-3-en-1-amine
CID 21306607
N-cyclopent-3-en-1-yl-4-methylpyrrolidine-3-carboxamide
CID 115976512
(2R)-2-amino-N-cyclopent-3-en-1-ylpropanamide
CID 104863900
2-chloro-N-cyclopent-3-en-1-ylpropanamide
CID 115879969
(3S,4S)-N-cyclopent-3-en-1-yl-4-methylpyrrolidine-3-carboxamide;hydrochloride
CID 131110722
carbanide;N-methylcyclopent-3-en-1-amine;platinum(4+)
CID 153492119
1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide
CID 115277550
cis-(1R,3S)-3-(cyclohex-3-ene-1-carbonylamino)cyclopentane-1-carboxylic acid
CID 106320857
(2S)-N-cyclopent-3-en-1-ylpyrrolidine-2-carboxamide
CID 104863890

Frequently Asked Questions

What is the IUPAC name of N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide?
The IUPAC name of N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide (CID 164651418) is N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide.
What is the SMILES notation for N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide?
The canonical SMILES for N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide is CNC1CC(C(=O)NC2CC=CC2)C1.
What is the InChIKey of N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide?
The InChIKey is BJGGPQOPJGZPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-12-10-6-8(7-10)11(14)13-9-4-2-3-5-9/h2-3,8-10,12H,4-7H2,1H3,(H,13,14).
What are the key properties of N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide?
N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide has a molecular weight of 194.28 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopent-3-en-1-yl-3-(methylamino)cyclobutane-1-carboxamide is sourced from PubChem (CID 164651418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).