N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide

C15H17N3O2 — CID 119617767

IUPACN-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide
SMILESNCC(NC(=O)c1coc(-c2ccccc2)n1)C1CC1
InChIInChI=1S/C15H17N3O2/c16-8-12(10-6-7-10)17-14(19)13-9-20-15(18-13)11-4-2-1-3-5-11/h1-5,9-10,12H,6-8,16H2,(H,17,19)
InChIKeyUTCWLJTYMSIDNJ-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.81
Rot. Bonds5

About N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide

N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide (PubChem CID 119617767) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide
PubChem CID119617767
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide
SMILESNCC(NC(=O)c1coc(-c2ccccc2)n1)C1CC1
InChIInChI=1S/C15H17N3O2/c16-8-12(10-6-7-10)17-14(19)13-9-20-15(18-13)11-4-2-1-3-5-11/h1-5,9-10,12H,6-8,16H2,(H,17,19)
InChIKeyUTCWLJTYMSIDNJ-UHFFFAOYSA-N
XLogP1.81
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-methyl-2-[(2-phenyl-1,3-oxazole-4-carbonyl)amino]pentanoate
CID 139229788
N-(2-amino-1-cyclopropylethyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 119615030
N-(2-amino-1-cyclopropylethyl)pyridine-2-carboxamide;dihydrochloride
CID 119617299
methyl 3-phenyl-2-[(2-phenyl-1,3-oxazole-4-carbonyl)amino]propanoate
CID 139229794
N-(2-amino-1-cyclohexylethyl)-5-phenyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 119589991
3,3-dimethyl-2-[(2-phenyl-1,3-oxazole-4-carbonyl)amino]butanoic acid
CID 91644907
3-methyl-2-[(2-phenyl-1,3-oxazole-4-carbonyl)amino]pentanoic acid
CID 119211721
2-(4-aminophenyl)-N-benzhydryl-1,3-oxazole-4-carboxamide
CID 3835810
2-phenyl-N-piperidin-4-yl-1,3-oxazole-4-carboxamide
CID 119390406
N-(2-amino-1-cyclopropylethyl)-1-phenylpyrazole-3-carboxamide;hydrochloride
CID 119617682
N-(2-amino-1-cyclopropylethyl)-2-benzyl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119613700
cyclopropylmethyl 2-phenyl-1,3-oxazole-4-carboxylate
CID 71452942

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide (CID 119617767) is N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide is NCC(NC(=O)c1coc(-c2ccccc2)n1)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide?
The InChIKey is UTCWLJTYMSIDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c16-8-12(10-6-7-10)17-14(19)13-9-20-15(18-13)11-4-2-1-3-5-11/h1-5,9-10,12H,6-8,16H2,(H,17,19).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide?
N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-2-phenyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 119617767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).