2-amino-N-(2-methylphenyl)propanamide;hydrochloride

C10H15ClN2O — CID 56832187

IUPAC2-amino-N-(2-methylphenyl)propanamide;hydrochloride
SMILESCc1ccccc1NC(=O)C(C)N.Cl
InChIInChI=1S/C10H14N2O.ClH/c1-7-5-3-4-6-9(7)12-10(13)8(2)11;/h3-6,8H,11H2,1-2H3,(H,12,13);1H
InChIKeyVAPLQUSKIPUVQX-UHFFFAOYSA-N
MW214.70 g/mol
LogP1.70
Rot. Bonds2

About 2-amino-N-(2-methylphenyl)propanamide;hydrochloride

2-amino-N-(2-methylphenyl)propanamide;hydrochloride (PubChem CID 56832187) has the molecular formula C10H15ClN2O and a molecular weight of 214.70 g/mol. Its IUPAC name is 2-amino-N-(2-methylphenyl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2-methylphenyl)propanamide;hydrochloride
PubChem CID56832187
Molecular FormulaC10H15ClN2O
Molecular Weight214.70 g/mol
Exact Mass214.09
IUPAC Name2-amino-N-(2-methylphenyl)propanamide;hydrochloride
SMILESCc1ccccc1NC(=O)C(C)N.Cl
InChIInChI=1S/C10H14N2O.ClH/c1-7-5-3-4-6-9(7)12-10(13)8(2)11;/h3-6,8H,11H2,1-2H3,(H,12,13);1H
InChIKeyVAPLQUSKIPUVQX-UHFFFAOYSA-N
XLogP1.70
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.70
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(2,3-dimethylphenyl)propanamide
CID 22690572
(2S)-2-amino-4-methyl-N-(2-methylphenyl)pentanamide;hydrochloride
CID 119670479
(2R)-2-amino-N-(2-aminophenyl)propanamide;hydrochloride
CID 131153716
(2S)-2-amino-3,3-dimethyl-N-(2-methylphenyl)butanamide;hydrochloride
CID 119670466
2-amino-N-(2-fluorophenyl)propanamide;hydrochloride
CID 75973817
(2S)-2-amino-4-methyl-N-(2-methylphenyl)pentanamide
CID 22691032
2-chloro-N-(2-methylphenyl)propanamide
CID 3858908
(2S)-2-amino-N-(2-bromophenyl)propanamide
CID 22690580
2-amino-N-(2-fluorophenyl)propanamide
CID 24707617
2-amino-N-(2-chlorophenyl)propanamide
CID 24704539
(2S)-2-amino-N-(2-iodophenyl)propanamide
CID 28882935
2-amino-N-(2-cyano-3-methylphenyl)propanamide
CID 107804990

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methylphenyl)propanamide;hydrochloride?
The IUPAC name of 2-amino-N-(2-methylphenyl)propanamide;hydrochloride (CID 56832187) is 2-amino-N-(2-methylphenyl)propanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2-methylphenyl)propanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2-methylphenyl)propanamide;hydrochloride is Cc1ccccc1NC(=O)C(C)N.Cl.
What is the InChIKey of 2-amino-N-(2-methylphenyl)propanamide;hydrochloride?
The InChIKey is VAPLQUSKIPUVQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.ClH/c1-7-5-3-4-6-9(7)12-10(13)8(2)11;/h3-6,8H,11H2,1-2H3,(H,12,13);1H.
What are the key properties of 2-amino-N-(2-methylphenyl)propanamide;hydrochloride?
2-amino-N-(2-methylphenyl)propanamide;hydrochloride has a molecular weight of 214.70 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methylphenyl)propanamide;hydrochloride is sourced from PubChem (CID 56832187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).