(5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone

C10H15N3O2 — CID 22427500

IUPAC(5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone
SMILESCc1cc(C(=O)N2CCN(C)CC2)no1
InChIInChI=1S/C10H15N3O2/c1-8-7-9(11-15-8)10(14)13-5-3-12(2)4-6-13/h7H,3-6H2,1-2H3
InChIKeyIXYDNEBSJDAVPY-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.37
Rot. Bonds1

About (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone

(5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone (PubChem CID 22427500) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone
PubChem CID22427500
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name(5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone
SMILESCc1cc(C(=O)N2CCN(C)CC2)no1
InChIInChI=1S/C10H15N3O2/c1-8-7-9(11-15-8)10(14)13-5-3-12(2)4-6-13/h7H,3-6H2,1-2H3
InChIKeyIXYDNEBSJDAVPY-UHFFFAOYSA-N
XLogP0.37
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone?
The IUPAC name of (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone (CID 22427500) is (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone.
What is the SMILES notation for (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone?
The canonical SMILES for (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone is Cc1cc(C(=O)N2CCN(C)CC2)no1.
What is the InChIKey of (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone?
The InChIKey is IXYDNEBSJDAVPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8-7-9(11-15-8)10(14)13-5-3-12(2)4-6-13/h7H,3-6H2,1-2H3.
What are the key properties of (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone?
(5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone has a molecular weight of 209.25 g/mol, XLogP of 0.37, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1,2-oxazol-3-yl)-(4-methylpiperazin-1-yl)methanone is sourced from PubChem (CID 22427500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).