2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride

C13H21ClN2O — CID 119330274

IUPAC2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride
SMILESCc1ccc(CC(C)N(C)C(=O)CN)cc1.Cl
InChIInChI=1S/C13H20N2O.ClH/c1-10-4-6-12(7-5-10)8-11(2)15(3)13(16)9-14;/h4-7,11H,8-9,14H2,1-3H3;1H
InChIKeySWRAYUXMKWZEET-UHFFFAOYSA-N
MW256.78 g/mol
LogP1.76
Rot. Bonds4

About 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride

2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride (PubChem CID 119330274) has the molecular formula C13H21ClN2O and a molecular weight of 256.78 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride
PubChem CID119330274
Molecular FormulaC13H21ClN2O
Molecular Weight256.78 g/mol
Exact Mass256.13
IUPAC Name2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride
SMILESCc1ccc(CC(C)N(C)C(=O)CN)cc1.Cl
InChIInChI=1S/C13H20N2O.ClH/c1-10-4-6-12(7-5-10)8-11(2)15(3)13(16)9-14;/h4-7,11H,8-9,14H2,1-3H3;1H
InChIKeySWRAYUXMKWZEET-UHFFFAOYSA-N
XLogP1.76
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.78
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide
CID 165361906
2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]pentanamide;hydrochloride
CID 119330280
2-(cyclopropylmethylamino)-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride
CID 119795541
2-(cyclopropylmethylamino)-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide
CID 119795542
N-(1-aminopropan-2-yl)-N-methyl-4-(4-methylphenyl)butanamide
CID 119584493
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide
CID 119795544
N-(1-aminopropan-2-yl)-N-methyl-5-(4-methylphenyl)pentanamide
CID 119582075
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide;hydrochloride
CID 119319100
2-(aminomethyl)-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]-1,3-thiazole-4-carboxamide
CID 119795550
4-(aminomethyl)-N-methyl-N-[1-(4-methylphenyl)butan-2-yl]benzamide;hydrochloride
CID 75429854
2-amino-N-[4-(cyclodecapentaenyl)butan-2-yl]-N-methylacetamide
CID 123171697
N-(1-aminopropan-2-yl)-N-methyl-2-[4-(2-methylpropyl)phenyl]acetamide
CID 119583475

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride (CID 119330274) is 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride is Cc1ccc(CC(C)N(C)C(=O)CN)cc1.Cl.
What is the InChIKey of 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride?
The InChIKey is SWRAYUXMKWZEET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O.ClH/c1-10-4-6-12(7-5-10)8-11(2)15(3)13(16)9-14;/h4-7,11H,8-9,14H2,1-3H3;1H.
What are the key properties of 2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride?
2-amino-N-methyl-N-[1-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride has a molecular weight of 256.78 g/mol, XLogP of 1.76, 4 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-(4-methylphenyl)propan-2-yl]acetamide;hydrochloride is sourced from PubChem (CID 119330274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).