(2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide

C14H22N2O2 — CID 62520326

IUPAC(2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide
SMILESCCC(CC)(CO)NC(=O)[C@H](N)c1ccccc1
InChIInChI=1S/C14H22N2O2/c1-3-14(4-2,10-17)16-13(18)12(15)11-8-6-5-7-9-11/h5-9,12,17H,3-4,10,15H2,1-2H3,(H,16,18)/t12-/m1/s1
InChIKeyUBZREUMDJNQATC-GFCCVEGCSA-N
MW250.34 g/mol
LogP1.35
Rot. Bonds6

About (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide

(2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide (PubChem CID 62520326) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide
PubChem CID62520326
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name(2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide
SMILESCCC(CC)(CO)NC(=O)[C@H](N)c1ccccc1
InChIInChI=1S/C14H22N2O2/c1-3-14(4-2,10-17)16-13(18)12(15)11-8-6-5-7-9-11/h5-9,12,17H,3-4,10,15H2,1-2H3,(H,16,18)/t12-/m1/s1
InChIKeyUBZREUMDJNQATC-GFCCVEGCSA-N
XLogP1.35
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide 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-(1,3-dihydroxy-2-methylpropan-2-yl)-2-phenylacetamide
CID 104898280
2-(carbamoylamino)-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide
CID 62521560
N-[3-(hydroxymethyl)pentan-3-yl]-2-methoxy-2-phenylacetamide
CID 62521933
(2S)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-2-phenylacetamide
CID 105058224
(2S)-2-amino-2-phenyl-N-(2,4,4-trimethylpentan-2-yl)acetamide
CID 104897348
2-amino-N-(2,2-diethylbutyl)-2-phenylacetamide
CID 119345468
2-amino-2-phenyl-N-propan-2-ylacetamide;hydrochloride
CID 22262716
2-amino-N-ethyl-2-phenylacetamide
CID 22262703
3-[[(2R)-2-amino-2-phenylacetyl]amino]-3-methylbutanamide
CID 106096490
2-amino-N-(2,2-diethylbutyl)-2-phenylacetamide;hydrochloride
CID 119345467
N-[3-(hydroxymethyl)pentan-3-yl]benzamide
CID 55209778
3-amino-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenylpropanamide
CID 107852996

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide?
The IUPAC name of (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide (CID 62520326) is (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide?
The canonical SMILES for (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide is CCC(CC)(CO)NC(=O)[C@H](N)c1ccccc1.
What is the InChIKey of (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide?
The InChIKey is UBZREUMDJNQATC-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-14(4-2,10-17)16-13(18)12(15)11-8-6-5-7-9-11/h5-9,12,17H,3-4,10,15H2,1-2H3,(H,16,18)/t12-/m1/s1.
What are the key properties of (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide?
(2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide has a molecular weight of 250.34 g/mol, XLogP of 1.35, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-2-phenylacetamide is sourced from PubChem (CID 62520326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).