(2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide

C14H22N2O2 — CID 105058270

IUPAC(2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide
SMILESCC(C)[C@@H](N)C(=O)NC(C)(CO)c1ccccc1
InChIInChI=1S/C14H22N2O2/c1-10(2)12(15)13(18)16-14(3,9-17)11-7-5-4-6-8-11/h4-8,10,12,17H,9,15H2,1-3H3,(H,16,18)/t12-,14?/m1/s1
InChIKeyAKVHVYBVGWEDOJ-PUODRLBUSA-N
MW250.34 g/mol
LogP0.99
Rot. Bonds5

About (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide

(2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide (PubChem CID 105058270) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide
PubChem CID105058270
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name(2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide
SMILESCC(C)[C@@H](N)C(=O)NC(C)(CO)c1ccccc1
InChIInChI=1S/C14H22N2O2/c1-10(2)12(15)13(18)16-14(3,9-17)11-7-5-4-6-8-11/h4-8,10,12,17H,9,15H2,1-3H3,(H,16,18)/t12-,14?/m1/s1
InChIKeyAKVHVYBVGWEDOJ-PUODRLBUSA-N
XLogP0.99
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-2-phenylacetamide
CID 105058224
(2S)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)pentanamide
CID 107570839
2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)pentanamide
CID 105058238
N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyl-3-(methylamino)propanamide
CID 105058116
(1-hydroxy-2-phenylpropan-2-yl)urea
CID 105059189
2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide
CID 105058068
3-amino-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058260
N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058812
N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyrazol-1-ylpropanamide
CID 105058962
ethyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate
CID 105059191
(2S)-2-amino-3-methyl-N-(2-methyl-4-phenylbutan-2-yl)butanamide
CID 104863039
N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylpentanamide
CID 105058924

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide?
The IUPAC name of (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide (CID 105058270) is (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide.
What is the SMILES notation for (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide?
The canonical SMILES for (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide is CC(C)[C@@H](N)C(=O)NC(C)(CO)c1ccccc1.
What is the InChIKey of (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide?
The InChIKey is AKVHVYBVGWEDOJ-PUODRLBUSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10(2)12(15)13(18)16-14(3,9-17)11-7-5-4-6-8-11/h4-8,10,12,17H,9,15H2,1-3H3,(H,16,18)/t12-,14?/m1/s1.
What are the key properties of (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide?
(2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide has a molecular weight of 250.34 g/mol, XLogP of 0.99, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide is sourced from PubChem (CID 105058270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).