2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide

C15H24N2O3 — CID 105058068

IUPAC2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)NC(C)(CO)c1ccccc1
InChIInChI=1S/C15H24N2O3/c1-15(11-18,12-7-4-3-5-8-12)17-14(19)13(16)9-6-10-20-2/h3-5,7-8,13,18H,6,9-11,16H2,1-2H3,(H,17,19)
InChIKeyBOSWNYOARDGESX-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.76
Rot. Bonds8

About 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide

2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide (PubChem CID 105058068) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide.

Molecular Properties

Compound Name2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide
PubChem CID105058068
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)NC(C)(CO)c1ccccc1
InChIInChI=1S/C15H24N2O3/c1-15(11-18,12-7-4-3-5-8-12)17-14(19)13(16)9-6-10-20-2/h3-5,7-8,13,18H,6,9-11,16H2,1-2H3,(H,17,19)
InChIKeyBOSWNYOARDGESX-UHFFFAOYSA-N
XLogP0.76
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(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
(2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide
CID 105058270
(2S)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-2-phenylacetamide
CID 105058224
2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-(3-methoxypropyl)propanamide
CID 105058024
2-amino-N-benzyl-5-methoxypentanamide
CID 81081027
2-(3-methoxypropylamino)-2-phenylpropan-1-ol
CID 115621374
(2S)-2-[(2-amino-5-methoxypentanoyl)amino]-2-phenylacetic acid
CID 103871010
(1-hydroxy-2-phenylpropan-2-yl)urea
CID 105059189
2-amino-5-methoxy-N-(2,4,4-trimethylpentan-2-yl)pentanamide
CID 81082635
2-amino-N-(2-hydroxyphenyl)-5-methoxypentanamide
CID 81089431
2-amino-N-[(2-hydroxyphenyl)methyl]-5-methoxypentanamide
CID 114332295

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide?
The IUPAC name of 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide (CID 105058068) is 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide.
What is the SMILES notation for 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide?
The canonical SMILES for 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide is COCCCC(N)C(=O)NC(C)(CO)c1ccccc1.
What is the InChIKey of 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide?
The InChIKey is BOSWNYOARDGESX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-15(11-18,12-7-4-3-5-8-12)17-14(19)13(16)9-6-10-20-2/h3-5,7-8,13,18H,6,9-11,16H2,1-2H3,(H,17,19).
What are the key properties of 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide?
2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide has a molecular weight of 280.37 g/mol, XLogP of 0.76, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-5-methoxypentanamide is sourced from PubChem (CID 105058068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).