(4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone

C15H24N2O2 — CID 106829733

IUPAC(4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone
SMILESCCCn1ncc(OC)c1C(=O)C1(C)CCCCC1
InChIInChI=1S/C15H24N2O2/c1-4-10-17-13(12(19-3)11-16-17)14(18)15(2)8-6-5-7-9-15/h11H,4-10H2,1-3H3
InChIKeyXQYXAAMVZOIKRG-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.45
Rot. Bonds5

About (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone

(4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone (PubChem CID 106829733) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone.

Molecular Properties

Compound Name(4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone
PubChem CID106829733
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name(4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone
SMILESCCCn1ncc(OC)c1C(=O)C1(C)CCCCC1
InChIInChI=1S/C15H24N2O2/c1-4-10-17-13(12(19-3)11-16-17)14(18)15(2)8-6-5-7-9-15/h11H,4-10H2,1-3H3
InChIKeyXQYXAAMVZOIKRG-UHFFFAOYSA-N
XLogP3.45
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3-ethylpyrrolidin-3-yl)-(4-methoxy-1-propylpyrazol-5-yl)methanone
CID 114669216
2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone
CID 114669614
cyclohexyl-(4-methoxy-1-propylpyrazol-5-yl)methanone
CID 114639235
cyclopenten-1-yl-(4-methoxy-1-propylpyrazol-5-yl)methanone
CID 103448192
(4-chloro-1-propylpyrazol-5-yl)-(3-methylpiperidin-3-yl)methanone
CID 114669182
(1,5-dimethylpyrazol-4-yl)-(4-methoxy-1-propylpyrazol-5-yl)methanone
CID 105133531
1-(4-methoxy-1-propylpyrazol-5-yl)decan-1-one
CID 115810940
3-amino-1-(4-methoxy-1-propylpyrazol-5-yl)-2-methylpropan-1-one
CID 114668938
(1-ethyl-4-methoxypyrazol-5-yl)-(3-propylpiperidin-3-yl)methanone
CID 114669187
(4-bromo-1-propylpyrazol-5-yl)-(3-methylpyrrolidin-3-yl)methanone
CID 114669204
2-(1-aminocyclohexyl)-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanone
CID 114669627
1,4-dithian-2-yl-(4-methoxy-1-propylpyrazol-5-yl)methanone
CID 114641533

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone?
The IUPAC name of (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone (CID 106829733) is (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone.
What is the SMILES notation for (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone?
The canonical SMILES for (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone is CCCn1ncc(OC)c1C(=O)C1(C)CCCCC1.
What is the InChIKey of (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone?
The InChIKey is XQYXAAMVZOIKRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-10-17-13(12(19-3)11-16-17)14(18)15(2)8-6-5-7-9-15/h11H,4-10H2,1-3H3.
What are the key properties of (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone?
(4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone has a molecular weight of 264.37 g/mol, XLogP of 3.45, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone is sourced from PubChem (CID 106829733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).