4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole

C12H18N2 — CID 172782788

IUPAC4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole
SMILESCCC1CC=C(c2cnn(C)c2)CC1
InChIInChI=1S/C12H18N2/c1-3-10-4-6-11(7-5-10)12-8-13-14(2)9-12/h6,8-10H,3-5,7H2,1-2H3
InChIKeyOMGUPWMDCSOZPX-UHFFFAOYSA-N
MW190.29 g/mol
LogP3.01
Rot. Bonds2

About 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole

4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole (PubChem CID 172782788) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole.

Molecular Properties

Compound Name4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole
PubChem CID172782788
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole
SMILESCCC1CC=C(c2cnn(C)c2)CC1
InChIInChI=1S/C12H18N2/c1-3-10-4-6-11(7-5-10)12-8-13-14(2)9-12/h6,8-10H,3-5,7H2,1-2H3
InChIKeyOMGUPWMDCSOZPX-UHFFFAOYSA-N
XLogP3.01
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole 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

1-(4-ethylcyclohexen-1-yl)-4-heptoxybenzene
CID 57220196
1-ethyl-4-[4-(4-ethylcyclohexen-1-yl)phenyl]-2,3-difluorobenzene
CID 142297519
5-ethyl-6-(1-methylpyrazol-4-yl)-4,5-dihydropyridazin-3-amine
CID 64691566
1-(4-decylcyclohexen-1-yl)-4-(4-hexylcyclohexen-1-yl)benzene
CID 20538384
N-(4-ethylcyclohexyl)-1-methylpyrazol-4-amine
CID 43535007
4-[4-(1-methylpyrazol-4-yl)phenyl]-1,2,3,6-tetrahydropyridine
CID 118144094
4-[4-[3-(1-methylpyrazol-4-yl)-1-sulfanylpyrrolo[2,3-b]pyridin-5-yl]cyclohex-3-en-1-yl]morpholine
CID 69050553
5-ethyl-2-[4-[[4-(4-ethylcyclohexen-1-yl)-2-fluorophenoxy]methyl]piperidin-1-yl]pyrimidine
CID 135370437
3-[(4S)-4-ethylcyclohexen-1-yl]-6-methoxybenzene-1,2-diol
CID 139146159
5-(4-ethylcyclohexyl)-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 58364603
4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one
CID 106952625
1-bromo-4-[4-(4-ethylcyclohexyl)cyclohexen-1-yl]benzene
CID 141297711

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole?
The IUPAC name of 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole (CID 172782788) is 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole.
What is the SMILES notation for 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole?
The canonical SMILES for 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole is CCC1CC=C(c2cnn(C)c2)CC1.
What is the InChIKey of 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole?
The InChIKey is OMGUPWMDCSOZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-3-10-4-6-11(7-5-10)12-8-13-14(2)9-12/h6,8-10H,3-5,7H2,1-2H3.
What are the key properties of 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole?
4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole has a molecular weight of 190.29 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole is sourced from PubChem (CID 172782788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).