(3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol

C15H24N2O2 — CID 103277409

IUPAC(3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol
SMILESCCn1ncc(OC)c1C(O)C1CC(C)=CC(C)C1
InChIInChI=1S/C15H24N2O2/c1-5-17-14(13(19-4)9-16-17)15(18)12-7-10(2)6-11(3)8-12/h6,9-10,12,15,18H,5,7-8H2,1-4H3
InChIKeyCGUNYGNNYXEWAU-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.94
Rot. Bonds4

About (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol

(3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol (PubChem CID 103277409) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol.

Molecular Properties

Compound Name(3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol
PubChem CID103277409
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name(3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol
SMILESCCn1ncc(OC)c1C(O)C1CC(C)=CC(C)C1
InChIInChI=1S/C15H24N2O2/c1-5-17-14(13(19-4)9-16-17)15(18)12-7-10(2)6-11(3)8-12/h6,9-10,12,15,18H,5,7-8H2,1-4H3
InChIKeyCGUNYGNNYXEWAU-UHFFFAOYSA-N
XLogP2.94
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1-ethyl-4-methoxypyrazol-5-yl)-(thiolan-3-yl)methanol
CID 105130248
7-bicyclo[4.1.0]heptanyl-(1-ethyl-4-methoxypyrazol-5-yl)methanol
CID 115837191
3-bicyclo[3.1.0]hexanyl-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 115837684
2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
CID 115837192
1,4-dioxan-2-yl-(1-ethyl-4-methoxypyrazol-5-yl)methanol
CID 115837206
(2,4-dimethoxyphenyl)-(3,5-dimethylcyclohex-3-en-1-yl)methanol
CID 103277687
(1-ethyl-4-methoxypyrazol-5-yl)-(2-ethyloxolan-3-yl)methanol
CID 114104696
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methylbutan-1-ol
CID 114635185
1-(1-ethyl-4-methoxypyrazol-5-yl)-2,2-dimethoxyethanol
CID 114636558
1-(3-bicyclo[3.1.0]hexanyl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine
CID 105047693
2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol
CID 114645947
1-(1-ethyl-4-methoxypyrazol-5-yl)-4-methylsulfanylbutan-1-ol
CID 103089700

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol?
The IUPAC name of (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol (CID 103277409) is (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol.
What is the SMILES notation for (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol?
The canonical SMILES for (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol is CCn1ncc(OC)c1C(O)C1CC(C)=CC(C)C1.
What is the InChIKey of (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol?
The InChIKey is CGUNYGNNYXEWAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-17-14(13(19-4)9-16-17)15(18)12-7-10(2)6-11(3)8-12/h6,9-10,12,15,18H,5,7-8H2,1-4H3.
What are the key properties of (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol?
(3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol has a molecular weight of 264.37 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylcyclohex-3-en-1-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol is sourced from PubChem (CID 103277409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).