2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride

C15H25ClN2O2 — CID 119334689

IUPAC2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride
SMILESCC(O)CC(C)(C)CNC(=O)C(N)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-11(18)9-15(2,3)10-17-14(19)13(16)12-7-5-4-6-8-12;/h4-8,11,13,18H,9-10,16H2,1-3H3,(H,17,19);1H
InChIKeyDEZIUTJHKQYKFU-UHFFFAOYSA-N
MW300.83 g/mol
LogP2.02
Rot. Bonds6

About 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride

2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride (PubChem CID 119334689) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride
PubChem CID119334689
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC Name2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride
SMILESCC(O)CC(C)(C)CNC(=O)C(N)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-11(18)9-15(2,3)10-17-14(19)13(16)12-7-5-4-6-8-12;/h4-8,11,13,18H,9-10,16H2,1-3H3,(H,17,19);1H
InChIKeyDEZIUTJHKQYKFU-UHFFFAOYSA-N
XLogP2.02
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.83
LogP ≤ 52.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(4-hydroxy-2,2-dimethylpentyl)-3-phenylpropanamide;hydrochloride
CID 119952032
(2R)-2-amino-N-(3-methoxy-2,2-dimethylpropyl)-2-phenylacetamide
CID 56861248
(2R)-2-amino-N-[(2S)-2-hydroxypropyl]-2-phenylacetamide
CID 93083385
3-[(2-amino-2-phenylacetyl)amino]-2-hydroxy-2-methylpropanoic acid
CID 66174922
(2S)-2-amino-N-(2-methyl-2-phenylpropyl)-2-phenylacetamide
CID 104897542
2-amino-N-(2,2-diethylbutyl)-2-phenylacetamide;hydrochloride
CID 119345467
1-benzhydryl-3-(4-hydroxy-2,2-dimethylpentyl)urea
CID 111503860
2-amino-N-(2-methyl-2-methylsulfanylpropyl)-2-phenylacetamide
CID 113264228
2-amino-N-[2-methyl-2-(2-methylphenyl)propyl]-2-phenylacetamide;hydrochloride
CID 119308089
2-amino-N-(2,2-diethylbutyl)-2-phenylacetamide
CID 119345468
methyl 3-[(2-amino-2-phenylacetyl)amino]-2,2-dimethylpropanoate
CID 119326915
2-amino-N-(2-ethyl-2-methylsulfanylbutyl)-2-phenylacetamide
CID 103797832

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride?
The IUPAC name of 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride (CID 119334689) is 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride is CC(O)CC(C)(C)CNC(=O)C(N)c1ccccc1.Cl.
What is the InChIKey of 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride?
The InChIKey is DEZIUTJHKQYKFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-11(18)9-15(2,3)10-17-14(19)13(16)12-7-5-4-6-8-12;/h4-8,11,13,18H,9-10,16H2,1-3H3,(H,17,19);1H.
What are the key properties of 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride?
2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 2.02, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-hydroxy-2,2-dimethylpentyl)-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 119334689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).