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

C10H15N3O2 — CID 20868333

IUPAC(3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone
SMILESCc1cc(C(=O)N2CCN(C)CC2)on1
InChIInChI=1S/C10H15N3O2/c1-8-7-9(15-11-8)10(14)13-5-3-12(2)4-6-13/h7H,3-6H2,1-2H3
InChIKeyFYAJBWGIRLFAQX-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.37
Rot. Bonds1

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

(3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone (PubChem CID 20868333) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone
PubChem CID20868333
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name(3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone
SMILESCc1cc(C(=O)N2CCN(C)CC2)on1
InChIInChI=1S/C10H15N3O2/c1-8-7-9(15-11-8)10(14)13-5-3-12(2)4-6-13/h7H,3-6H2,1-2H3
InChIKeyFYAJBWGIRLFAQX-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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Related Compounds

(3,5-dimethylphenyl)-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]methanone
CID 32517272
methyl 4-(3-methyl-1,2-oxazole-5-carbonyl)piperazine-1-carboxylate
CID 78904854
(4-hydroxy-4-methylpiperidin-1-yl)-(3-methyl-1,2-oxazol-5-yl)methanone
CID 80707380
furan-3-yl-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]methanone
CID 32532619
(3-methyl-1,2-oxazol-5-yl)-[4-(oxan-4-yl)piperazin-1-yl]methanone
CID 136512064
(3-methyl-1,2-oxazol-5-yl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone
CID 43060282
3-(4-methylpiperazine-1-carbonyl)-1,2-oxazole-5-carboxylic acid
CID 107368983
(3-aminoazetidin-1-yl)-(3-methyl-1,2-oxazol-5-yl)methanone
CID 65244680
[4-(1-aminoethyl)piperidin-1-yl]-(3-methyl-1,2-oxazol-5-yl)methanone
CID 63596014
[4-(aminomethyl)piperidin-1-yl]-(3-methyl-1,2-oxazol-5-yl)methanone;hydrochloride
CID 119423963
2-(1-aminocyclobutyl)-1-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]ethanone
CID 91645490
[(3R,4R)-3-(hydroxymethyl)-4-[(4-methyl-1,4-diazepan-1-yl)methyl]pyrrolidin-1-yl]-(3-methyl-1,2-oxazol-5-yl)methanone
CID 72902862

Frequently Asked Questions

What is the IUPAC name of (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone?
The IUPAC name of (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone (CID 20868333) is (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone.
What is the SMILES notation for (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone?
The canonical SMILES for (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone is Cc1cc(C(=O)N2CCN(C)CC2)on1.
What is the InChIKey of (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone?
The InChIKey is FYAJBWGIRLFAQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8-7-9(15-11-8)10(14)13-5-3-12(2)4-6-13/h7H,3-6H2,1-2H3.
What are the key properties of (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone?
(3-methyl-1,2-oxazol-5-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 (3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone is sourced from PubChem (CID 20868333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).