4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide

C15H20N2O — CID 79211306

IUPAC4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide
SMILESCC(C)c1ccccc1NC(=O)C1C=CC(N)C1
InChIInChI=1S/C15H20N2O/c1-10(2)13-5-3-4-6-14(13)17-15(18)11-7-8-12(16)9-11/h3-8,10-12H,9,16H2,1-2H3,(H,17,18)
InChIKeyDNERIQSLPBSCCN-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.65
Rot. Bonds3

About 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide

4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide (PubChem CID 79211306) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide
PubChem CID79211306
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide
SMILESCC(C)c1ccccc1NC(=O)C1C=CC(N)C1
InChIInChI=1S/C15H20N2O/c1-10(2)13-5-3-4-6-14(13)17-15(18)11-7-8-12(16)9-11/h3-8,10-12H,9,16H2,1-2H3,(H,17,18)
InChIKeyDNERIQSLPBSCCN-UHFFFAOYSA-N
XLogP2.65
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.65
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

4-amino-N-(2,3-dimethylphenyl)cyclopent-2-ene-1-carboxamide
CID 79211393
4-amino-N-[2-(difluoromethoxy)phenyl]cyclopent-2-ene-1-carboxamide
CID 79210360
4-amino-N-[2-methyl-3-(propanoylamino)phenyl]cyclopent-2-ene-1-carboxamide
CID 79208809
4-amino-N-(2-ethoxy-3-pyridinyl)cyclopent-2-ene-1-carboxamide
CID 79210696
2-N-phenyl-1-N-(2-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
CID 109140809
N-(2-propan-2-ylphenyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 42909018
2-[(4-aminocyclopent-2-ene-1-carbonyl)amino]-6-chlorobenzoic acid
CID 79208298
4-[(2-propan-2-ylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63788003
4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)cyclohexane-1,4-dicarboxamide
CID 109144556
4-amino-N-(1,3-dimethylpyrazol-4-yl)cyclopent-2-ene-1-carboxamide
CID 102805596
(1S,6R)-6-[(2-propan-2-ylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate
CID 6953281
2-N-(3,4-difluorophenyl)-1-N-(2-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
CID 109142345

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide?
The IUPAC name of 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide (CID 79211306) is 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide.
What is the SMILES notation for 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide?
The canonical SMILES for 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide is CC(C)c1ccccc1NC(=O)C1C=CC(N)C1.
What is the InChIKey of 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide?
The InChIKey is DNERIQSLPBSCCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10(2)13-5-3-4-6-14(13)17-15(18)11-7-8-12(16)9-11/h3-8,10-12H,9,16H2,1-2H3,(H,17,18).
What are the key properties of 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide?
4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide has a molecular weight of 244.34 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-propan-2-ylphenyl)cyclopent-2-ene-1-carboxamide is sourced from PubChem (CID 79211306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).