(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide

C15H22N2O3 — CID 81130811

IUPAC(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide
SMILESN[C@H](Cc1ccccc1)C(=O)NCC1(O)CCOCC1
InChIInChI=1S/C15H22N2O3/c16-13(10-12-4-2-1-3-5-12)14(18)17-11-15(19)6-8-20-9-7-15/h1-5,13,19H,6-11,16H2,(H,17,18)/t13-/m1/s1
InChIKeyNNROXNNFBVDZCO-CYBMUJFWSA-N
MW278.35 g/mol
LogP0.21
Rot. Bonds5

About (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide

(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide (PubChem CID 81130811) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide
PubChem CID81130811
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide
SMILESN[C@H](Cc1ccccc1)C(=O)NCC1(O)CCOCC1
InChIInChI=1S/C15H22N2O3/c16-13(10-12-4-2-1-3-5-12)14(18)17-11-15(19)6-8-20-9-7-15/h1-5,13,19H,6-11,16H2,(H,17,18)/t13-/m1/s1
InChIKeyNNROXNNFBVDZCO-CYBMUJFWSA-N
XLogP0.21
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide 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

(2S)-2-amino-N-[(1-hydroxycyclohexyl)methyl]-3-phenylpropanamide
CID 79004655
(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide
CID 81130040
(2S)-2-amino-N-[[1-(hydroxymethyl)cyclopropyl]methyl]-3-phenylpropanamide
CID 81433068
(2R)-2-amino-N-[[1-(hydroxymethyl)cyclopropyl]methyl]-3-phenylpropanamide
CID 81433594
N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide
CID 79038917
4-[[(2R)-2-amino-3-phenylpropanoyl]amino]oxane-4-carboxylic acid
CID 115292457
2-amino-N-[(1-hydroxycyclopentyl)methyl]-3-(4-hydroxyphenyl)propanamide
CID 77056076
(2S)-2-amino-N-[(1-methylcyclobutyl)methyl]-3-phenylpropanamide
CID 103797671
2-amino-N-[(3-morpholin-4-ylthiolan-3-yl)methyl]-3-phenylpropanamide;dihydrochloride
CID 119862768
2-[1-[[(2-amino-3-phenylpropanoyl)amino]methyl]cyclohexyl]acetic acid
CID 11507997
2-[1-[[[(2S)-2-amino-3-phenylpropanoyl]amino]methyl]cyclobutyl]acetic acid
CID 81164897
(2S)-2-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]-3-phenylpropanamide
CID 81494200

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide (CID 81130811) is (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide is N[C@H](Cc1ccccc1)C(=O)NCC1(O)CCOCC1.
What is the InChIKey of (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide?
The InChIKey is NNROXNNFBVDZCO-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H22N2O3/c16-13(10-12-4-2-1-3-5-12)14(18)17-11-15(19)6-8-20-9-7-15/h1-5,13,19H,6-11,16H2,(H,17,18)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide?
(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide has a molecular weight of 278.35 g/mol, XLogP of 0.21, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide is sourced from PubChem (CID 81130811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).