3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol

C11H20N2O — CID 114554038

IUPAC3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol
SMILESCCC(CC)CC(O)c1ccnn1C
InChIInChI=1S/C11H20N2O/c1-4-9(5-2)8-11(14)10-6-7-12-13(10)3/h6-7,9,11,14H,4-5,8H2,1-3H3
InChIKeyJQUACKTULANEEQ-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.28
Rot. Bonds5

About 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol

3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol (PubChem CID 114554038) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol
PubChem CID114554038
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol
SMILESCCC(CC)CC(O)c1ccnn1C
InChIInChI=1S/C11H20N2O/c1-4-9(5-2)8-11(14)10-6-7-12-13(10)3/h6-7,9,11,14H,4-5,8H2,1-3H3
InChIKeyJQUACKTULANEEQ-UHFFFAOYSA-N
XLogP2.28
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylpyrazol-3-yl)hexan-1-ol
CID 63960741
N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine
CID 105176670
2-ethylsulfanyl-1-(2-methylpyrazol-3-yl)ethanol
CID 65131088
1-(2-methylpyrazol-3-yl)-2-propan-2-ylsulfanylethanol
CID 65134458
3-amino-1-(2-methylpyrazol-3-yl)propan-1-ol
CID 82595670
3,3,3-trifluoro-1-(2-methylpyrazol-3-yl)propan-1-ol
CID 63961178
1-(2,5-dimethylpyrazol-3-yl)-3-ethylpentan-1-ol
CID 105122554
1-(2-methylpyrazol-3-yl)propylhydrazine
CID 105200909
4-methoxy-1-(2-methylpyrazol-3-yl)pentan-1-ol
CID 105098269
2-ethyl-N-[1-(2-methylpyrazol-3-yl)ethyl]butan-1-amine
CID 106758131
2-cyclopentyl-1-(2-methylpyrazol-3-yl)ethanol
CID 114554130
2,3-dihydroxy-3-(2-methylpyrazol-3-yl)propanoic acid
CID 170825003

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol?
The IUPAC name of 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol (CID 114554038) is 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol.
What is the SMILES notation for 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol?
The canonical SMILES for 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol is CCC(CC)CC(O)c1ccnn1C.
What is the InChIKey of 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol?
The InChIKey is JQUACKTULANEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-4-9(5-2)8-11(14)10-6-7-12-13(10)3/h6-7,9,11,14H,4-5,8H2,1-3H3.
What are the key properties of 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol?
3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol has a molecular weight of 196.29 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol is sourced from PubChem (CID 114554038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).