(1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol

C16H28N2O — CID 105104498

IUPAC(1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol
SMILESCCc1cc(C(O)C2CCCC(CC)C2)n(CC)n1
InChIInChI=1S/C16H28N2O/c1-4-12-8-7-9-13(10-12)16(19)15-11-14(5-2)17-18(15)6-3/h11-13,16,19H,4-10H2,1-3H3
InChIKeyUBSVZYWSAVYVNA-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.72
Rot. Bonds5

About (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol

(1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol (PubChem CID 105104498) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol.

Molecular Properties

Compound Name(1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol
PubChem CID105104498
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name(1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol
SMILESCCc1cc(C(O)C2CCCC(CC)C2)n(CC)n1
InChIInChI=1S/C16H28N2O/c1-4-12-8-7-9-13(10-12)16(19)15-11-14(5-2)17-18(15)6-3/h11-13,16,19H,4-10H2,1-3H3
InChIKeyUBSVZYWSAVYVNA-UHFFFAOYSA-N
XLogP3.72
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1,3-diethylpyrazol-5-yl)-(4-methylcyclohexyl)methanol
CID 105102592
(3-ethylcyclohexyl)-(3-methylimidazol-4-yl)methanol
CID 66117130
(1,3-diethylpyrazol-5-yl)-(oxolan-3-yl)methanol
CID 105097748
(3-ethylcyclohexyl)-(3-propylimidazol-4-yl)methanol
CID 66130637
1-cyclobutyl-3-(1,3-diethylpyrazol-5-yl)propan-2-ol
CID 103170098
(3-ethylcyclohexyl)-(1-methylimidazol-2-yl)methanol
CID 65400333
1-(1,3-diethylpyrazol-5-yl)-2-methylpropan-1-ol
CID 105133593
[cyclohexyl-(1,3-diethylpyrazol-5-yl)methyl]hydrazine
CID 105282054
(3-ethylcyclohexyl)-(2,4,6-trifluorophenyl)methanol
CID 115808567
1-cyclohexyl-1-(1,3-diethylpyrazol-5-yl)-N-methylmethanamine
CID 105079431
(3-ethylcyclohexyl)-(2-phenyltriazol-4-yl)methanol
CID 105104541
N-[(3-ethylcyclohexyl)-(2-ethyl-5-methylpyrazol-3-yl)methyl]propan-1-amine
CID 105156057

Frequently Asked Questions

What is the IUPAC name of (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol?
The IUPAC name of (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol (CID 105104498) is (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol.
What is the SMILES notation for (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol?
The canonical SMILES for (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol is CCc1cc(C(O)C2CCCC(CC)C2)n(CC)n1.
What is the InChIKey of (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol?
The InChIKey is UBSVZYWSAVYVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-4-12-8-7-9-13(10-12)16(19)15-11-14(5-2)17-18(15)6-3/h11-13,16,19H,4-10H2,1-3H3.
What are the key properties of (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol?
(1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol has a molecular weight of 264.41 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol is sourced from PubChem (CID 105104498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).