(1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone

C11H17N3O — CID 130516291

IUPAC(1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone
SMILESCC1CNCCC1C(=O)c1cn(C)cn1
InChIInChI=1S/C11H17N3O/c1-8-5-12-4-3-9(8)11(15)10-6-14(2)7-13-10/h6-9,12H,3-5H2,1-2H3
InChIKeyIXXJBZJYWTZACT-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.85
Rot. Bonds2

About (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone

(1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone (PubChem CID 130516291) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone.

Molecular Properties

Compound Name(1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone
PubChem CID130516291
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name(1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone
SMILESCC1CNCCC1C(=O)c1cn(C)cn1
InChIInChI=1S/C11H17N3O/c1-8-5-12-4-3-9(8)11(15)10-6-14(2)7-13-10/h6-9,12H,3-5H2,1-2H3
InChIKeyIXXJBZJYWTZACT-UHFFFAOYSA-N
XLogP0.85
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Bulbimidazole C
CID 156011654
Bulbimidazole A
CID 156011696
1H-imidazol-5-yl(piperidin-4-yl)methanone
CID 11252330
5H,6H,7H,8H-imidazo(1,5-a)pyridin-8-one
CID 16752069
Strepimidazole D
CID 156580782
Strepimidazole A
CID 156580783
Strepimidazole C
CID 156580784
1-(1H-imidazol-5-yl)pentan-1-one
CID 573558
1-{5H,6H,7H,8H-imidazo[1,2-a]pyrimidin-3-yl}ethan-1-one
CID 136559933
1-(1,2-Dimethylimidazol-4-yl)-4,4-dimethylpentan-1-one
CID 15882308
1-(1H-imidazol-5-yl)-2,2-dimethylpropan-1-one
CID 565435
Cyclohexyl(1H-imidazol-5-yl)methanone
CID 565606

Frequently Asked Questions

What is the IUPAC name of (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone?
The IUPAC name of (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone (CID 130516291) is (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone.
What is the SMILES notation for (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone?
The canonical SMILES for (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone is CC1CNCCC1C(=O)c1cn(C)cn1.
What is the InChIKey of (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone?
The InChIKey is IXXJBZJYWTZACT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-5-12-4-3-9(8)11(15)10-6-14(2)7-13-10/h6-9,12H,3-5H2,1-2H3.
What are the key properties of (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone?
(1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone has a molecular weight of 207.28 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylimidazol-4-yl)-(3-methylpiperidin-4-yl)methanone is sourced from PubChem (CID 130516291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).