2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide

C11H17N3O3 — CID 3308744

IUPAC2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
SMILESCC(O)C(N)c1nc(C(=O)NC2CCC2)co1
InChIInChI=1S/C11H17N3O3/c1-6(15)9(12)11-14-8(5-17-11)10(16)13-7-3-2-4-7/h5-7,9,15H,2-4,12H2,1H3,(H,13,16)
InChIKeyXRGLJBHOVGZLAN-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.34
Rot. Bonds4

About 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide

2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide (PubChem CID 3308744) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
PubChem CID3308744
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
SMILESCC(O)C(N)c1nc(C(=O)NC2CCC2)co1
InChIInChI=1S/C11H17N3O3/c1-6(15)9(12)11-14-8(5-17-11)10(16)13-7-3-2-4-7/h5-7,9,15H,2-4,12H2,1H3,(H,13,16)
InChIKeyXRGLJBHOVGZLAN-UHFFFAOYSA-N
XLogP0.34
TPSA101.38 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-aminopropyl)-N-cyclohexyl-1,3-oxazole-4-carboxamide
CID 3865431
2-(1-amino-2-hydroxypropyl)-N-dodecyl-1,3-oxazole-4-carboxamide
CID 3868123
2-(1-amino-2-hydroxypropyl)-N-heptyl-1,3-oxazole-4-carboxamide
CID 3868124
2-(1-aminobutyl)-N-cyclopropyl-1,3-oxazole-4-carboxamide
CID 5156440
2-(1-aminoethyl)-N-(2,3-dimethylcyclohexyl)-1,3-oxazole-4-carboxamide
CID 3868928
2-amino-N-cyclohexyl-1,3-oxazole-4-carboxamide
CID 110848950
2-(1-amino-2-hydroxypropyl)-N-(2-morpholin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 3829164
2-(2-aminoethyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
CID 3254419
2-[1-amino-2-(4-hydroxyphenyl)ethyl]-N-cyclopropyl-1,3-oxazole-4-carboxamide
CID 3866332
2-cyclobutyl-N-[4-[(2-cyclobutyl-1,3-oxazole-4-carbonyl)amino]cyclohexyl]-1,3-oxazole-4-carboxamide
CID 167759305
2-(4-aminophenyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide
CID 3871183
N-[4-(4-aminobenzoyl)phenyl]-2-(1-amino-2-hydroxypropyl)-1,3-oxazole-4-carboxamide
CID 3864832

Frequently Asked Questions

What is the IUPAC name of 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide (CID 3308744) is 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide is CC(O)C(N)c1nc(C(=O)NC2CCC2)co1.
What is the InChIKey of 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide?
The InChIKey is XRGLJBHOVGZLAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-6(15)9(12)11-14-8(5-17-11)10(16)13-7-3-2-4-7/h5-7,9,15H,2-4,12H2,1H3,(H,13,16).
What are the key properties of 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide?
2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide has a molecular weight of 239.27 g/mol, XLogP of 0.34, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-amino-2-hydroxypropyl)-N-cyclobutyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 3308744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).