2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride

C14H23ClN2O — CID 119271101

IUPAC2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)N(C)C(C)c1ccccc1.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-4-8-13(15)14(17)16(3)11(2)12-9-6-5-7-10-12;/h5-7,9-11,13H,4,8,15H2,1-3H3;1H
InChIKeyNTAOIQFZIAOEAD-UHFFFAOYSA-N
MW270.80 g/mol
LogP2.76
Rot. Bonds5

About 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride

2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride (PubChem CID 119271101) has the molecular formula C14H23ClN2O and a molecular weight of 270.80 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride
PubChem CID119271101
Molecular FormulaC14H23ClN2O
Molecular Weight270.80 g/mol
Exact Mass270.15
IUPAC Name2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)N(C)C(C)c1ccccc1.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-4-8-13(15)14(17)16(3)11(2)12-9-6-5-7-10-12;/h5-7,9-11,13H,4,8,15H2,1-3H3;1H
InChIKeyNTAOIQFZIAOEAD-UHFFFAOYSA-N
XLogP2.76
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.80
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[1-[4-(2-methoxyphenyl)phenyl]ethyl]-N-methylpentanamide;hydrochloride
CID 119334352
(2S)-2-amino-N-methyl-N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]pentanamide
CID 124682679
2-amino-N-[1-(2-chlorophenyl)ethyl]-N-methylpentanamide
CID 54870533
2-(aminomethyl)-N-methyl-N-(1-phenylethyl)pentanamide
CID 65230078
(2S,3S)-2-amino-N,3-dimethyl-N-(1-phenylethyl)pentanamide
CID 61164093
2-amino-N-butyl-N-(1-phenylethyl)pentanamide
CID 119331563
(2S)-2-amino-N-methyl-N-(1-pyridin-4-ylethyl)hexanamide
CID 113357165
methyl(1-phenylethyl)carbamic acid
CID 67062794
2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]pentanamide;hydrochloride
CID 119330280
2-amino-N-methyl-4-phenyl-N-propan-2-ylbutanamide
CID 114924872
3-amino-N,2-dimethyl-N-[1-(4-methylphenyl)ethyl]-3-phenylpropanamide
CID 119717391
(2S)-2-amino-N-[1-(2-hydroxyphenyl)ethyl]-N-methylbutanamide
CID 79024859

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride (CID 119271101) is 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride is CCCC(N)C(=O)N(C)C(C)c1ccccc1.Cl.
What is the InChIKey of 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride?
The InChIKey is NTAOIQFZIAOEAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O.ClH/c1-4-8-13(15)14(17)16(3)11(2)12-9-6-5-7-10-12;/h5-7,9-11,13H,4,8,15H2,1-3H3;1H.
What are the key properties of 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride?
2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride has a molecular weight of 270.80 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(1-phenylethyl)pentanamide;hydrochloride is sourced from PubChem (CID 119271101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).