2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride

C15H25ClN2O — CID 119674328

IUPAC2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)N(CC)Cc1ccccc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-4-11-15(3,16)14(18)17(5-2)12-13-9-7-6-8-10-13;/h6-10H,4-5,11-12,16H2,1-3H3;1H
InChIKeyIMEQVOYVSYUBAL-UHFFFAOYSA-N
MW284.83 g/mol
LogP2.97
Rot. Bonds6

About 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride

2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride (PubChem CID 119674328) has the molecular formula C15H25ClN2O and a molecular weight of 284.83 g/mol. Its IUPAC name is 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride
PubChem CID119674328
Molecular FormulaC15H25ClN2O
Molecular Weight284.83 g/mol
Exact Mass284.17
IUPAC Name2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)N(CC)Cc1ccccc1.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-4-11-15(3,16)14(18)17(5-2)12-13-9-7-6-8-10-13;/h6-10H,4-5,11-12,16H2,1-3H3;1H
InChIKeyIMEQVOYVSYUBAL-UHFFFAOYSA-N
XLogP2.97
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.83
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-benzyl-N-ethyl-2-methylpentanamide
CID 60846660
2-amino-N-benzyl-N,2-dimethylpentanamide
CID 60848746
2-amino-N-benzyl-2-methyl-N-propylbutanamide
CID 79797442
3-[benzyl(ethyl)amino]-2,2-dimethyl-3-oxopropanoic acid
CID 82812836
2-amino-N-ethyl-N-(furan-2-ylmethyl)-2-methylpentanamide
CID 60947093
2-amino-N,N-dibenzyl-2-ethylbutanamide
CID 130161860
2-amino-N-ethyl-2-methyl-N-(2-phenylethyl)butanamide
CID 79805499
N,N'-dibenzyl-N,N'-diethyloxamide
CID 3417048
2-amino-N-[[4-(dimethylamino)phenyl]methyl]-N-ethyl-2-methylbutanamide
CID 79805312
N,N'-dibenzyl-N,N'-diethylpentanediamide
CID 68902262
benzyl 2-amino-2-methylpentanoate
CID 61276990
N-benzyl-N-ethylcarbamoyl chloride
CID 10679448

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride (CID 119674328) is 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride is CCCC(C)(N)C(=O)N(CC)Cc1ccccc1.Cl.
What is the InChIKey of 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride?
The InChIKey is IMEQVOYVSYUBAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O.ClH/c1-4-11-15(3,16)14(18)17(5-2)12-13-9-7-6-8-10-13;/h6-10H,4-5,11-12,16H2,1-3H3;1H.
What are the key properties of 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride?
2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride has a molecular weight of 284.83 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-benzyl-N-ethyl-2-methylpentanamide;hydrochloride is sourced from PubChem (CID 119674328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).