(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol

C14H24N2O2 — CID 116753279

IUPAC(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)C1(OC)CCCCC1
InChIInChI=1S/C14H24N2O2/c1-3-11-16-12(7-10-15-16)13(17)14(18-2)8-5-4-6-9-14/h7,10,13,17H,3-6,8-9,11H2,1-2H3
InChIKeyNCEMKGPPODLCNX-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.68
Rot. Bonds5

About (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol

(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol (PubChem CID 116753279) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol
PubChem CID116753279
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)C1(OC)CCCCC1
InChIInChI=1S/C14H24N2O2/c1-3-11-16-12(7-10-15-16)13(17)14(18-2)8-5-4-6-9-14/h7,10,13,17H,3-6,8-9,11H2,1-2H3
InChIKeyNCEMKGPPODLCNX-UHFFFAOYSA-N
XLogP2.68
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-methoxycyclopentyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
CID 104610857
(2-ethylpyrazol-3-yl)-(1-methoxy-4,4-dimethylcyclohexyl)methanol
CID 116755731
(4-bromo-1-propylpyrazol-5-yl)-(1-methoxycycloheptyl)methanol
CID 114645921
(2-ethylpyrazol-3-yl)-(1-methylcyclohexyl)methanol
CID 106830881
(3-ethyltriazol-4-yl)-(1-methoxycycloheptyl)methanol
CID 114213130
N-[(2-ethylpyrazol-3-yl)-(1-methoxycycloheptyl)methyl]ethanamine
CID 116770400
(1-methoxy-4,4-dimethylcyclohexyl)-(2-methylpyrazol-3-yl)methanol
CID 116755712
4-[hydroxy-(2-propylpyrazol-3-yl)methyl]oxane-4-carbonitrile
CID 114558157
[1-(dimethylamino)-4-methylcyclohexyl]-(2-propylpyrazol-3-yl)methanol
CID 79075090
(1-ethylimidazol-2-yl)-(1-methoxycyclohexyl)methanol
CID 116753476
(2-methyloxan-2-yl)-(2-propylpyrazol-3-yl)methanamine
CID 80683782
(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanone
CID 116748199

Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol?
The IUPAC name of (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol (CID 116753279) is (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol.
What is the SMILES notation for (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol?
The canonical SMILES for (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol is CCCn1nccc1C(O)C1(OC)CCCCC1.
What is the InChIKey of (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol?
The InChIKey is NCEMKGPPODLCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-3-11-16-12(7-10-15-16)13(17)14(18-2)8-5-4-6-9-14/h7,10,13,17H,3-6,8-9,11H2,1-2H3.
What are the key properties of (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol?
(1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol has a molecular weight of 252.36 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclohexyl)-(2-propylpyrazol-3-yl)methanol is sourced from PubChem (CID 116753279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).