5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide

C12H12N4O3 — CID 71795751

IUPAC5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide
SMILESCOc1cc(NC(=O)c2cc(C3CC3)on2)ncn1
InChIInChI=1S/C12H12N4O3/c1-18-11-5-10(13-6-14-11)15-12(17)8-4-9(19-16-8)7-2-3-7/h4-7H,2-3H2,1H3,(H,13,14,15,17)
InChIKeyIPZUBXDHKIDKHV-UHFFFAOYSA-N
MW260.25 g/mol
LogP1.60
Rot. Bonds4

About 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide (PubChem CID 71795751) has the molecular formula C12H12N4O3 and a molecular weight of 260.25 g/mol. Its IUPAC name is 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide
PubChem CID71795751
Molecular FormulaC12H12N4O3
Molecular Weight260.25 g/mol
Exact Mass260.09
IUPAC Name5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide
SMILESCOc1cc(NC(=O)c2cc(C3CC3)on2)ncn1
InChIInChI=1S/C12H12N4O3/c1-18-11-5-10(13-6-14-11)15-12(17)8-4-9(19-16-8)7-2-3-7/h4-7H,2-3H2,1H3,(H,13,14,15,17)
InChIKeyIPZUBXDHKIDKHV-UHFFFAOYSA-N
XLogP1.60
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.25
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(5-Cyclopropylisoxazol-3-yl)(4-(6-(trifluoromethyl)pyrimidin-4-yl)piperazin-1-yl)methanone
CID 91631510
2-[4-(5-Cyclopropyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]pyrimidine
CID 31943502
5-cyclopropyl-N-[6-(morpholin-4-yl)pyrimidin-4-yl]-1,2-oxazole-3-carboxamide
CID 71794867
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-methoxypyrimidin-4-yl)acetamide
CID 71795747
5-cyclopropyl-N-(6-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidin-4-yl)isoxazole-3-carboxamide
CID 72717805
5-cyclopropyl-N-(2-(4-methyl-6-(trifluoromethyl)pyrimidin-2-yl)ethyl)isoxazole-3-carboxamide
CID 71797005
5-cyclopropyl-N-(1-(2-methyl-6-(trifluoromethyl)pyrimidin-4-yl)piperidin-4-yl)isoxazole-3-carboxamide
CID 91817801
N-{[1-(2,6-dimethoxypyrimidin-4-yl)piperidin-4-yl]methyl}-5-methylisoxazole-3-carboxamide
CID 131898730
5-tert-butyl-N-(6-ethyl-2-methylpyrimidin-4-yl)-1,2-oxazole-3-carboxamide
CID 137984076
5-ethyl-N-[6-[(3Z)-5-fluoro-2-methoxyhexa-1,3,5-trien-3-yl]pyrimidin-4-yl]-1,2-oxazole-3-carboxamide
CID 143787809
N-[6-[(3Z)-5-fluoro-2-methoxyhexa-1,3,5-trien-3-yl]pyrimidin-4-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 143787848
5-isobutyl-N-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methyl}isoxazole-3-carboxamide
CID 50980108

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide (CID 71795751) is 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide is COc1cc(NC(=O)c2cc(C3CC3)on2)ncn1.
What is the InChIKey of 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is IPZUBXDHKIDKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O3/c1-18-11-5-10(13-6-14-11)15-12(17)8-4-9(19-16-8)7-2-3-7/h4-7H,2-3H2,1H3,(H,13,14,15,17).
What are the key properties of 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 260.25 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(6-methoxypyrimidin-4-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 71795751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).