(2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide

C17H24N2O2 — CID 104904891

IUPAC(2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide
SMILESC=CCN(C(=O)[C@H](N)Cc1ccc(O)cc1)C1CCCC1
InChIInChI=1S/C17H24N2O2/c1-2-11-19(14-5-3-4-6-14)17(21)16(18)12-13-7-9-15(20)10-8-13/h2,7-10,14,16,20H,1,3-6,11-12,18H2/t16-/m1/s1
InChIKeyXQCYNOITYOQLCK-MRXNPFEDSA-N
MW288.39 g/mol
LogP2.22
Rot. Bonds6

About (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide

(2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide (PubChem CID 104904891) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide
PubChem CID104904891
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name(2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide
SMILESC=CCN(C(=O)[C@H](N)Cc1ccc(O)cc1)C1CCCC1
InChIInChI=1S/C17H24N2O2/c1-2-11-19(14-5-3-4-6-14)17(21)16(18)12-13-7-9-15(20)10-8-13/h2,7-10,14,16,20H,1,3-6,11-12,18H2/t16-/m1/s1
InChIKeyXQCYNOITYOQLCK-MRXNPFEDSA-N
XLogP2.22
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzyl (3S)-3-amino-4-[cyclopentyl(prop-2-enyl)amino]-4-oxobutanoate
CID 114274705
(2S)-2-amino-N-butyl-N-cyclopropyl-3-(4-hydroxyphenyl)propanamide
CID 61165075
(2S)-2-amino-N-cyclopropyl-3-(4-hydroxyphenyl)-N-methylpropanamide
CID 61155702
(2S)-2-amino-N-cyclopentyl-N-prop-2-enylpropanamide
CID 61145863
2-amino-N-cyclopentyl-2-(4-methylphenyl)-N-prop-2-enylacetamide
CID 106312192
(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide
CID 78985362
2-amino-N-cyclopentyl-3-methyl-N-prop-2-enylbutanamide
CID 60947968
2-amino-N-cyclohexyl-N-ethyl-3-phenylpropanamide;hydrochloride
CID 56831881
2-amino-3-(4-hydroxyphenyl)-N-methyl-N-(4-methylcyclohexyl)propanamide
CID 76895085
2-amino-3-cyclohexylpropanoic acid;(2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid
CID 175252899
3-amino-N-cyclopentyl-2-phenyl-N-prop-2-enylpropanamide
CID 62877146
prop-2-enyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate;hydrochloride
CID 138991803

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide?
The IUPAC name of (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide (CID 104904891) is (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide?
The canonical SMILES for (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide is C=CCN(C(=O)[C@H](N)Cc1ccc(O)cc1)C1CCCC1.
What is the InChIKey of (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide?
The InChIKey is XQCYNOITYOQLCK-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-2-11-19(14-5-3-4-6-14)17(21)16(18)12-13-7-9-15(20)10-8-13/h2,7-10,14,16,20H,1,3-6,11-12,18H2/t16-/m1/s1.
What are the key properties of (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide?
(2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide has a molecular weight of 288.39 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-cyclopentyl-3-(4-hydroxyphenyl)-N-prop-2-enylpropanamide is sourced from PubChem (CID 104904891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).