2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol

C16H28N2O — CID 82695455

IUPAC2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)C(n2nc(CC)cc2CC)C1
InChIInChI=1S/C16H28N2O/c1-4-7-12-8-9-16(19)15(10-12)18-14(6-3)11-13(5-2)17-18/h11-12,15-16,19H,4-10H2,1-3H3
InChIKeyDORGHGVQDRJHHO-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.51
Rot. Bonds5

About 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol

2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol (PubChem CID 82695455) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol
PubChem CID82695455
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)C(n2nc(CC)cc2CC)C1
InChIInChI=1S/C16H28N2O/c1-4-7-12-8-9-16(19)15(10-12)18-14(6-3)11-13(5-2)17-18/h11-12,15-16,19H,4-10H2,1-3H3
InChIKeyDORGHGVQDRJHHO-UHFFFAOYSA-N
XLogP3.51
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 ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-diethylpyrazol-1-yl)-4-ethylcyclohexan-1-amine
CID 82692586
3-(3,5-diethylpyrazol-1-yl)cyclopentan-1-amine
CID 82692472
2-(3,5-diethylpyrazol-1-yl)cyclopentan-1-amine
CID 82692230
2-indazol-1-yl-4-propylcyclohexan-1-ol
CID 55040790
3-(3,5-diethylpyrazol-1-yl)-4-methylpiperidine
CID 82695446
(2S)-2-methyl-4-propylcyclohexan-1-ol
CID 177268723
[4-tert-butyl-2-(3,5-diethylpyrazol-1-yl)cyclohexyl]methanamine
CID 82696080
N-[[2-(3,5-diethylpyrazol-1-yl)cyclobutyl]methyl]cyclopropanamine
CID 82693803
2-(3-amino-5-ethylpyrazol-1-yl)cyclopentan-1-ol
CID 62712670
3-(3,5-diethylpyrazol-1-yl)-N-methyloxan-4-amine
CID 82693590
3-(3,5-diethylpyrazol-1-yl)-N-ethylcyclohexan-1-amine
CID 82692471
2-(3-azaspiro[5.5]undecan-3-yl)-4-propylcyclohexan-1-ol
CID 63472871

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol?
The IUPAC name of 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol (CID 82695455) is 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol.
What is the SMILES notation for 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol?
The canonical SMILES for 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol is CCCC1CCC(O)C(n2nc(CC)cc2CC)C1.
What is the InChIKey of 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol?
The InChIKey is DORGHGVQDRJHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-4-7-12-8-9-16(19)15(10-12)18-14(6-3)11-13(5-2)17-18/h11-12,15-16,19H,4-10H2,1-3H3.
What are the key properties of 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol?
2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol has a molecular weight of 264.41 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-diethylpyrazol-1-yl)-4-propylcyclohexan-1-ol is sourced from PubChem (CID 82695455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).