N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride

C15H25ClN2O — CID 119529641

IUPACN-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride
SMILESCC(C)C(C)CC(=O)NCC(N)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-11(2)12(3)9-15(18)17-10-14(16)13-7-5-4-6-8-13;/h4-8,11-12,14H,9-10,16H2,1-3H3,(H,17,18);1H
InChIKeyOGODXRKPBXIVPR-UHFFFAOYSA-N
MW284.83 g/mol
LogP2.91
Rot. Bonds6

About N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride

N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride (PubChem CID 119529641) has the molecular formula C15H25ClN2O and a molecular weight of 284.83 g/mol. Its IUPAC name is N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride
PubChem CID119529641
Molecular FormulaC15H25ClN2O
Molecular Weight284.83 g/mol
Exact Mass284.17
IUPAC NameN-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride
SMILESCC(C)C(C)CC(=O)NCC(N)c1ccccc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-11(2)12(3)9-15(18)17-10-14(16)13-7-5-4-6-8-13;/h4-8,11-12,14H,9-10,16H2,1-3H3,(H,17,18);1H
InChIKeyOGODXRKPBXIVPR-UHFFFAOYSA-N
XLogP2.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.83
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-phenylethyl)-3,4,4-trimethylpentanamide
CID 63833481
N-[(2S)-2-amino-2-phenylethyl]propanamide
CID 95015221
3-amino-3-phenyl-N-(2-phenylpropyl)propanamide
CID 61253056
N-(2-amino-2-phenylethyl)-2-propan-2-yloxyacetamide;hydrochloride
CID 119529017
methyl 3-[(3-amino-3-phenylpropanoyl)amino]-2-methylpropanoate
CID 119951074
3-amino-N-(2-methylbutyl)-3-phenylpropanamide
CID 62693740
3-amino-N-[2-(dimethylamino)-4-methylpentyl]-3-phenylpropanamide;dihydrochloride
CID 119952947
(2S)-2-amino-N-(2-amino-2-phenylethyl)-3,3-dimethylbutanamide
CID 122080430
(2-amino-2-phenylethyl)carbamic acid
CID 66941802
3-amino-N-(2-methoxy-2-phenylethyl)-3-phenylpropanamide;hydrochloride
CID 119949370
N-(2-amino-2-phenylethyl)-2-(dimethylamino)-3-methylbutanamide
CID 119528234
N-(2-amino-2-phenylethyl)-2-ethoxyacetamide;hydrochloride
CID 119528845

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride?
The IUPAC name of N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride (CID 119529641) is N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride is CC(C)C(C)CC(=O)NCC(N)c1ccccc1.Cl.
What is the InChIKey of N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride?
The InChIKey is OGODXRKPBXIVPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O.ClH/c1-11(2)12(3)9-15(18)17-10-14(16)13-7-5-4-6-8-13;/h4-8,11-12,14H,9-10,16H2,1-3H3,(H,17,18);1H.
What are the key properties of N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride?
N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride has a molecular weight of 284.83 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-phenylethyl)-3,4-dimethylpentanamide;hydrochloride is sourced from PubChem (CID 119529641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).