(3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone

C10H11N3O2 — CID 1245127

IUPAC(3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone
SMILESCc1cnn(C(=O)c2c(C)noc2C)c1
InChIInChI=1S/C10H11N3O2/c1-6-4-11-13(5-6)10(14)9-7(2)12-15-8(9)3/h4-5H,1-3H3
InChIKeyMTTUKQHSFGBXTP-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.48
Rot. Bonds1

About (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone

(3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone (PubChem CID 1245127) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone.

Molecular Properties

Compound Name(3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone
PubChem CID1245127
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name(3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone
SMILESCc1cnn(C(=O)c2c(C)noc2C)c1
InChIInChI=1S/C10H11N3O2/c1-6-4-11-13(5-6)10(14)9-7(2)12-15-8(9)3/h4-5H,1-3H3
InChIKeyMTTUKQHSFGBXTP-UHFFFAOYSA-N
XLogP1.48
TPSA60.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone?
The IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone (CID 1245127) is (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone.
What is the SMILES notation for (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone?
The canonical SMILES for (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone is Cc1cnn(C(=O)c2c(C)noc2C)c1.
What is the InChIKey of (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone?
The InChIKey is MTTUKQHSFGBXTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-6-4-11-13(5-6)10(14)9-7(2)12-15-8(9)3/h4-5H,1-3H3.
What are the key properties of (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone?
(3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone has a molecular weight of 205.22 g/mol, XLogP of 1.48, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1,2-oxazol-4-yl)-(4-methylpyrazol-1-yl)methanone is sourced from PubChem (CID 1245127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).