[3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol

C11H19N3O — CID 115092826

IUPAC[3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol
SMILESCN1CCCC(Cc2cc(CO)[nH]n2)C1
InChIInChI=1S/C11H19N3O/c1-14-4-2-3-9(7-14)5-10-6-11(8-15)13-12-10/h6,9,15H,2-5,7-8H2,1H3,(H,12,13)
InChIKeyMPADAVSYSIGXJA-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.79
Rot. Bonds3

About [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol

[3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol (PubChem CID 115092826) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol.

Molecular Properties

Compound Name[3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol
PubChem CID115092826
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol
SMILESCN1CCCC(Cc2cc(CO)[nH]n2)C1
InChIInChI=1S/C11H19N3O/c1-14-4-2-3-9(7-14)5-10-6-11(8-15)13-12-10/h6,9,15H,2-5,7-8H2,1H3,(H,12,13)
InChIKeyMPADAVSYSIGXJA-UHFFFAOYSA-N
XLogP0.79
TPSA52.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[(1-methylpyrrolidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol
CID 115092302
[3-[(1-propan-2-ylpiperidin-4-yl)methyl]-1H-pyrazol-5-yl]methanol
CID 115092392
[2-[(1-methylpiperidin-3-yl)methyl]-1,3-thiazol-4-yl]methanol
CID 115088901
3-[(1-methylpiperidin-3-yl)methyl]pyridazine
CID 117106273
N,N-dimethyl-6-[[(3S)-1-methylpiperidin-3-yl]methyl]pyrimidin-4-amine
CID 95841173
2-bromo-5-[[(3S)-1-methylpiperidin-3-yl]methyl]pyrazine
CID 129407000
[2-[(1-methylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol
CID 117153570
[5-[[(3S)-1-methylpiperidin-3-yl]methyl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 95842690
5-[(1-ethylpiperidin-3-yl)methyl]-1H-pyrazol-3-amine
CID 115092847
2-bromo-6-[[(3S)-1-methylpiperidin-3-yl]methyl]pyridine
CID 124641722
azocan-1-yl-[5-[[(3R)-1-methylpiperidin-3-yl]methyl]pyrazin-2-yl]methanone
CID 95829493
[3-[(3S)-1-(2-methylpropyl)piperidin-3-yl]-1H-pyrazol-5-yl]methanol
CID 95842997

Frequently Asked Questions

What is the IUPAC name of [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol?
The IUPAC name of [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol (CID 115092826) is [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol.
What is the SMILES notation for [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol?
The canonical SMILES for [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol is CN1CCCC(Cc2cc(CO)[nH]n2)C1.
What is the InChIKey of [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol?
The InChIKey is MPADAVSYSIGXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-14-4-2-3-9(7-14)5-10-6-11(8-15)13-12-10/h6,9,15H,2-5,7-8H2,1H3,(H,12,13).
What are the key properties of [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol?
[3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol has a molecular weight of 209.29 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(1-methylpiperidin-3-yl)methyl]-1H-pyrazol-5-yl]methanol is sourced from PubChem (CID 115092826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).