2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride

C15H25ClN2O2 — CID 119345419

IUPAC2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride
SMILESCC(O)CC(CNC(=O)C(C)(C)N)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-11(18)9-13(12-7-5-4-6-8-12)10-17-14(19)15(2,3)16;/h4-8,11,13,18H,9-10,16H2,1-3H3,(H,17,19);1H
InChIKeyPCPCVAAARBDJFJ-UHFFFAOYSA-N
MW300.83 g/mol
LogP1.82
Rot. Bonds6

About 2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride

2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride (PubChem CID 119345419) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is 2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride
PubChem CID119345419
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC Name2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride
SMILESCC(O)CC(CNC(=O)C(C)(C)N)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-11(18)9-13(12-7-5-4-6-8-12)10-17-14(19)15(2,3)16;/h4-8,11,13,18H,9-10,16H2,1-3H3,(H,17,19);1H
InChIKeyPCPCVAAARBDJFJ-UHFFFAOYSA-N
XLogP1.82
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 ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-[(2S,4R)-4-hydroxy-2-phenylpentyl]carbamate
CID 97086612
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2-amino-N-(4-hydroxy-2-phenylpentyl)pentanamide;hydrochloride
CID 119345437
3-(2-aminophenyl)-N-(4-hydroxy-2-phenylpentyl)propanamide;hydrochloride
CID 120611894
N-(4-hydroxy-2-phenylpentyl)-4-(methylamino)butanamide;hydrochloride
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5-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylbenzamide;hydrochloride
CID 120639082
4-phenylheptane-2,6-diol
CID 173150769
N-(4-hydroxy-2-phenylpentyl)-3-oxocyclobutane-1-carboxamide
CID 110004037
N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide
CID 97086628
3-amino-N-(4-hydroxy-2-phenylpentyl)cyclohexane-1-carboxamide
CID 119821976
2-chloro-N-(4-hydroxy-2-phenylpentyl)-4,5-dimethylbenzamide
CID 110027851
N-(2-amino-2-phenylethyl)-2,2-dimethylpropanamide;hydrochloride
CID 119529465

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride?
The IUPAC name of 2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride (CID 119345419) is 2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride is CC(O)CC(CNC(=O)C(C)(C)N)c1ccccc1.Cl.
What is the InChIKey of 2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride?
The InChIKey is PCPCVAAARBDJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-11(18)9-13(12-7-5-4-6-8-12)10-17-14(19)15(2,3)16;/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-phenylpentyl)-2-methylpropanamide;hydrochloride?
2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 1.82, 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-phenylpentyl)-2-methylpropanamide;hydrochloride is sourced from PubChem (CID 119345419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).