2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide

C17H24N2O — CID 106312192

IUPAC2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide
SMILESC=CCN(C(=O)C(N)c1ccc(C)cc1)C1CCCC1
InChIInChI=1S/C17H24N2O/c1-3-12-19(15-6-4-5-7-15)17(20)16(18)14-10-8-13(2)9-11-14/h3,8-11,15-16H,1,4-7,12,18H2,2H3
InChIKeyRQXKTDCVFRHDSV-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.95
Rot. Bonds5

About 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide

2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide (PubChem CID 106312192) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide
PubChem CID106312192
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide
SMILESC=CCN(C(=O)C(N)c1ccc(C)cc1)C1CCCC1
InChIInChI=1S/C17H24N2O/c1-3-12-19(15-6-4-5-7-15)17(20)16(18)14-10-8-13(2)9-11-14/h3,8-11,15-16H,1,4-7,12,18H2,2H3
InChIKeyRQXKTDCVFRHDSV-UHFFFAOYSA-N
XLogP2.95
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide?
The IUPAC name of 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide (CID 106312192) is 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide.
What is the SMILES notation for 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide?
The canonical SMILES for 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide is C=CCN(C(=O)C(N)c1ccc(C)cc1)C1CCCC1.
What is the InChIKey of 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide?
The InChIKey is RQXKTDCVFRHDSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-3-12-19(15-6-4-5-7-15)17(20)16(18)14-10-8-13(2)9-11-14/h3,8-11,15-16H,1,4-7,12,18H2,2H3.
What are the key properties of 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide?
2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide has a molecular weight of 272.39 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide is sourced from PubChem (CID 106312192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).