3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride

C14H18ClN3O2 — CID 119342913

IUPAC3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride
SMILESCc1coc(-c2ccc(C)c(NC(=O)CCN)c2)n1.Cl
InChIInChI=1S/C14H17N3O2.ClH/c1-9-3-4-11(14-16-10(2)8-19-14)7-12(9)17-13(18)5-6-15;/h3-4,7-8H,5-6,15H2,1-2H3,(H,17,18);1H
InChIKeyWHKOESUOUZJZNL-UHFFFAOYSA-N
MW295.77 g/mol
LogP2.67
Rot. Bonds4

About 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride

3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride (PubChem CID 119342913) has the molecular formula C14H18ClN3O2 and a molecular weight of 295.77 g/mol. Its IUPAC name is 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride
PubChem CID119342913
Molecular FormulaC14H18ClN3O2
Molecular Weight295.77 g/mol
Exact Mass295.11
IUPAC Name3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride
SMILESCc1coc(-c2ccc(C)c(NC(=O)CCN)c2)n1.Cl
InChIInChI=1S/C14H17N3O2.ClH/c1-9-3-4-11(14-16-10(2)8-19-14)7-12(9)17-13(18)5-6-15;/h3-4,7-8H,5-6,15H2,1-2H3,(H,17,18);1H
InChIKeyWHKOESUOUZJZNL-UHFFFAOYSA-N
XLogP2.67
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyethylamino)-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]acetamide;hydrochloride
CID 119817439
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CID 119343667
2-[2-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)anilino]-2-oxoethyl]-1,3-dihydroindene-2-carboxylic acid
CID 119163760
N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]-2-thiomorpholin-3-ylacetamide
CID 119940404
N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide
CID 166219072
5-amino-4-methyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide
CID 82013593
3-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]propanamide;hydrochloride
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5-cyclopropyl-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]-1H-pyrazole-3-carboxamide
CID 166219078
4-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)anilino]cyclohexane-1-carboxylic acid
CID 122029926
4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide
CID 60842599
N-(2,5-dimethylphenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 39427770
3-amino-N-(5-methyl-1H-indazol-6-yl)propanamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride?
The IUPAC name of 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride (CID 119342913) is 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride?
The canonical SMILES for 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride is Cc1coc(-c2ccc(C)c(NC(=O)CCN)c2)n1.Cl.
What is the InChIKey of 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride?
The InChIKey is WHKOESUOUZJZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2.ClH/c1-9-3-4-11(14-16-10(2)8-19-14)7-12(9)17-13(18)5-6-15;/h3-4,7-8H,5-6,15H2,1-2H3,(H,17,18);1H.
What are the key properties of 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride?
3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride has a molecular weight of 295.77 g/mol, XLogP of 2.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-methyl-5-(4-methyl-1,3-oxazol-2-yl)phenyl]propanamide;hydrochloride is sourced from PubChem (CID 119342913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).