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

C14H18ClN3O2 — CID 119704493

IUPAC3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride
SMILESCc1ncc(-c2ccc(NC(=O)CC(C)N)cc2)o1.Cl
InChIInChI=1S/C14H17N3O2.ClH/c1-9(15)7-14(18)17-12-5-3-11(4-6-12)13-8-16-10(2)19-13;/h3-6,8-9H,7,15H2,1-2H3,(H,17,18);1H
InChIKeyIEFFZFLSWOKYDY-UHFFFAOYSA-N
MW295.77 g/mol
LogP2.75
Rot. Bonds4

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

3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride (PubChem CID 119704493) has the molecular formula C14H18ClN3O2 and a molecular weight of 295.77 g/mol. Its IUPAC name is 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride
PubChem CID119704493
Molecular FormulaC14H18ClN3O2
Molecular Weight295.77 g/mol
Exact Mass295.11
IUPAC Name3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride
SMILESCc1ncc(-c2ccc(NC(=O)CC(C)N)cc2)o1.Cl
InChIInChI=1S/C14H17N3O2.ClH/c1-9(15)7-14(18)17-12-5-3-11(4-6-12)13-8-16-10(2)19-13;/h3-6,8-9H,7,15H2,1-2H3,(H,17,18);1H
InChIKeyIEFFZFLSWOKYDY-UHFFFAOYSA-N
XLogP2.75
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 ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-N,N'-bis[4-(2-methyl-1,3-oxazol-5-yl)phenyl]hexanediamide
CID 112830791
2-[2-[4-(2-methyl-1,3-oxazol-5-yl)anilino]-2-oxoethyl]sulfanyl-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]acetamide
CID 112830792
4-(methylamino)-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride
CID 119704467
2-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]pentanamide
CID 119279222
(2S)-2-amino-3,3-dimethyl-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide
CID 119704480
3-amino-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide
CID 60837809
[4-(2-methyl-1,3-oxazol-5-yl)phenyl]thiourea
CID 86632608
3-amino-N-(4-phenylphenyl)butanamide
CID 60835996
N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]prop-2-enamide
CID 166405051
3-amino-N-[4-(carbamoylamino)phenyl]butanamide;hydrochloride
CID 119701459
3-amino-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]butanamide;hydrochloride
CID 119694022
3-amino-N-(4-ethylphenyl)butanamide;hydrochloride
CID 119674065

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride?
The IUPAC name of 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride (CID 119704493) is 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride?
The canonical SMILES for 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride is Cc1ncc(-c2ccc(NC(=O)CC(C)N)cc2)o1.Cl.
What is the InChIKey of 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride?
The InChIKey is IEFFZFLSWOKYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2.ClH/c1-9(15)7-14(18)17-12-5-3-11(4-6-12)13-8-16-10(2)19-13;/h3-6,8-9H,7,15H2,1-2H3,(H,17,18);1H.
What are the key properties of 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride?
3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride has a molecular weight of 295.77 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[4-(2-methyl-1,3-oxazol-5-yl)phenyl]butanamide;hydrochloride is sourced from PubChem (CID 119704493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).