N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride

C12H18ClN3O3 — CID 119266368

IUPACN-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)C(C)N.Cl
InChIInChI=1S/C12H17N3O3.ClH/c1-7(13)12(17)15-10-6-9(14-8(2)16)4-5-11(10)18-3;/h4-7H,13H2,1-3H3,(H,14,16)(H,15,17);1H
InChIKeyPALFMOVYDLZERL-UHFFFAOYSA-N
MW287.75 g/mol
LogP1.36
Rot. Bonds4

About N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride

N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride (PubChem CID 119266368) has the molecular formula C12H18ClN3O3 and a molecular weight of 287.75 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
PubChem CID119266368
Molecular FormulaC12H18ClN3O3
Molecular Weight287.75 g/mol
Exact Mass287.10
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)C(C)N.Cl
InChIInChI=1S/C12H17N3O3.ClH/c1-7(13)12(17)15-10-6-9(14-8(2)16)4-5-11(10)18-3;/h4-7H,13H2,1-3H3,(H,14,16)(H,15,17);1H
InChIKeyPALFMOVYDLZERL-UHFFFAOYSA-N
XLogP1.36
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 51.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamido-4-methoxyphenyl)-2-amino-3-methylbutanamide;hydrochloride
CID 119278957
N-(5-acetamido-2-methoxyphenyl)-3-amino-2-methylpropanamide
CID 62671021
N-(3-acetamido-4-methoxyphenyl)-2-amino-3-methylbutanamide
CID 119278958
(2S)-2-amino-N-(5-chloro-2-methoxyphenyl)propanamide;hydrochloride
CID 119262144
(2S)-2-amino-N-(5-bromo-2-methoxyphenyl)propanamide;hydrochloride
CID 119292528
(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
CID 22690513
(2R)-N-(5-acetamido-2-fluorophenyl)-2-aminopropanamide;hydrochloride
CID 119279500
N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide
CID 60853865
2-amino-N-(5-tert-butyl-2-methoxyphenyl)propanamide
CID 43424856
(2R)-2-(5-acetamido-2-methoxyanilino)-N-(4-acetamidophenyl)propanamide
CID 9329057
N-(5-acetamido-2-methoxyphenyl)-2-(azetidin-3-yl)propanamide
CID 116675530
N-(4-acetamidophenyl)-2-aminopropanamide;hydrochloride
CID 119261426

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride (CID 119266368) is N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride is COc1ccc(NC(C)=O)cc1NC(=O)C(C)N.Cl.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride?
The InChIKey is PALFMOVYDLZERL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3.ClH/c1-7(13)12(17)15-10-6-9(14-8(2)16)4-5-11(10)18-3;/h4-7H,13H2,1-3H3,(H,14,16)(H,15,17);1H.
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride?
N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride has a molecular weight of 287.75 g/mol, XLogP of 1.36, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-aminopropanamide;hydrochloride is sourced from PubChem (CID 119266368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).