[5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol

C13H23N3O — CID 43266645

IUPAC[5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol
SMILESCCC1CCCCN1c1c(CO)c(C)nn1C
InChIInChI=1S/C13H23N3O/c1-4-11-7-5-6-8-16(11)13-12(9-17)10(2)14-15(13)3/h11,17H,4-9H2,1-3H3
InChIKeyJKGLISHTVDVPDS-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.99
Rot. Bonds3

About [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol

[5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol (PubChem CID 43266645) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol.

Molecular Properties

Compound Name[5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol
PubChem CID43266645
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name[5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol
SMILESCCC1CCCCN1c1c(CO)c(C)nn1C
InChIInChI=1S/C13H23N3O/c1-4-11-7-5-6-8-16(11)13-12(9-17)10(2)14-15(13)3/h11,17H,4-9H2,1-3H3
InChIKeyJKGLISHTVDVPDS-UHFFFAOYSA-N
XLogP1.99
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1,3-dimethyl-5-(2-methylpiperidin-1-yl)pyrazol-4-yl]methanol
CID 43122104
[5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine
CID 60974475
[1-[4-(aminomethyl)-1,3-dimethylpyrazol-5-yl]azepan-2-yl]methanol
CID 116634087
1-[4-(hydroxymethyl)-1,3-dimethylpyrazol-5-yl]-N-methylpiperidine-2-carboxamide
CID 54989738
2-[1,3-dimethyl-5-(2-propylpiperidin-1-yl)pyrazol-4-yl]ethanamine
CID 83057672
1-[4-(chloromethyl)-1,3-dimethylpyrazol-5-yl]-2-methylpiperidine
CID 43122170
5-[2-(2-hydroxyethyl)piperidin-1-yl]-1,3-dimethylpyrazole-4-carbothioamide
CID 55242689
2-[5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1,3-dimethylpyrazol-4-yl]ethanamine
CID 63784094
[2-(2-ethylpyrrolidin-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
CID 61254337
[5-[4-(cyclopropylmethyl)piperazin-1-yl]-1,3-dimethylpyrazol-4-yl]methanol
CID 61445720
1-[4-(hydroxymethyl)-1,3-dimethylpyrazol-5-yl]-4-methylpiperidin-3-ol
CID 102959804
3-[1-(4-carbamoyl-1,3-dimethylpyrazol-5-yl)piperidin-2-yl]propanoic acid
CID 63758176

Frequently Asked Questions

What is the IUPAC name of [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol?
The IUPAC name of [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol (CID 43266645) is [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol.
What is the SMILES notation for [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol?
The canonical SMILES for [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol is CCC1CCCCN1c1c(CO)c(C)nn1C.
What is the InChIKey of [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol?
The InChIKey is JKGLISHTVDVPDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-4-11-7-5-6-8-16(11)13-12(9-17)10(2)14-15(13)3/h11,17H,4-9H2,1-3H3.
What are the key properties of [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol?
[5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol has a molecular weight of 237.35 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol is sourced from PubChem (CID 43266645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).