N-(2-aminocyclopentene-1-carbonyl)benzamide

C13H14N2O2 — CID 10014076

IUPACN-(2-aminocyclopentene-1-carbonyl)benzamide
SMILESNC1=C(C(=O)NC(=O)c2ccccc2)CCC1
InChIInChI=1S/C13H14N2O2/c14-11-8-4-7-10(11)13(17)15-12(16)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,14H2,(H,15,16,17)
InChIKeyKURQMXSABKSAKK-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.34
Rot. Bonds2

About N-(2-aminocyclopentene-1-carbonyl)benzamide

N-(2-aminocyclopentene-1-carbonyl)benzamide (PubChem CID 10014076) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(2-aminocyclopentene-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(2-aminocyclopentene-1-carbonyl)benzamide
PubChem CID10014076
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC NameN-(2-aminocyclopentene-1-carbonyl)benzamide
SMILESNC1=C(C(=O)NC(=O)c2ccccc2)CCC1
InChIInChI=1S/C13H14N2O2/c14-11-8-4-7-10(11)13(17)15-12(16)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,14H2,(H,15,16,17)
InChIKeyKURQMXSABKSAKK-UHFFFAOYSA-N
XLogP1.34
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-2-benzamido-1,2-diphenylethenyl]benzamide
CID 2749417
N-carbamoylbenzamide;urea
CID 157303801
N-[4-[(2-aminocyclohexene-1-carbonyl)carbamoyl]phenyl]-6,8-dimethyl-2-(2-methylphenyl)quinoline-4-carboxamide
CID 177319699
N'-benzoyl-5,6,7,8-tetrahydronaphthalene-2-carbohydrazide
CID 9471660
N-methylbenzamide
CID 11954
benzohydrazide;molybdenum
CID 162076561
N-(benzoylcarbamothioyl)benzamide;ethene
CID 157078951
N-carbamothioylbenzamide;naphthalene
CID 20980035
N-benzoyl-3-bromobenzamide
CID 118577200
N-(propan-2-ylcarbamoyl)benzamide
CID 2986554
2-(phenylcarbamoyl)cyclohexene-1-carboxylic acid
CID 2812906
bis(1,2-diphenylethane-1,2-dione);hydrogen peroxide
CID 18415505

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopentene-1-carbonyl)benzamide?
The IUPAC name of N-(2-aminocyclopentene-1-carbonyl)benzamide (CID 10014076) is N-(2-aminocyclopentene-1-carbonyl)benzamide.
What is the SMILES notation for N-(2-aminocyclopentene-1-carbonyl)benzamide?
The canonical SMILES for N-(2-aminocyclopentene-1-carbonyl)benzamide is NC1=C(C(=O)NC(=O)c2ccccc2)CCC1.
What is the InChIKey of N-(2-aminocyclopentene-1-carbonyl)benzamide?
The InChIKey is KURQMXSABKSAKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c14-11-8-4-7-10(11)13(17)15-12(16)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,14H2,(H,15,16,17).
What are the key properties of N-(2-aminocyclopentene-1-carbonyl)benzamide?
N-(2-aminocyclopentene-1-carbonyl)benzamide has a molecular weight of 230.27 g/mol, XLogP of 1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopentene-1-carbonyl)benzamide is sourced from PubChem (CID 10014076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).