(1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol

C12H21N3O — CID 79584203

IUPAC(1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol
SMILESCc1c(C(O)C2CC(C)CCN2)cnn1C
InChIInChI=1S/C12H21N3O/c1-8-4-5-13-11(6-8)12(16)10-7-14-15(3)9(10)2/h7-8,11-13,16H,4-6H2,1-3H3
InChIKeyQWNJLHOGTNWWSA-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.15
Rot. Bonds2

About (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol

(1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol (PubChem CID 79584203) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol.

Molecular Properties

Compound Name(1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol
PubChem CID79584203
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name(1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol
SMILESCc1c(C(O)C2CC(C)CCN2)cnn1C
InChIInChI=1S/C12H21N3O/c1-8-4-5-13-11(6-8)12(16)10-7-14-15(3)9(10)2/h7-8,11-13,16H,4-6H2,1-3H3
InChIKeyQWNJLHOGTNWWSA-UHFFFAOYSA-N
XLogP1.15
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol?
The IUPAC name of (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol (CID 79584203) is (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol.
What is the SMILES notation for (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol?
The canonical SMILES for (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol is Cc1c(C(O)C2CC(C)CCN2)cnn1C.
What is the InChIKey of (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol?
The InChIKey is QWNJLHOGTNWWSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-8-4-5-13-11(6-8)12(16)10-7-14-15(3)9(10)2/h7-8,11-13,16H,4-6H2,1-3H3.
What are the key properties of (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol?
(1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol has a molecular weight of 223.32 g/mol, XLogP of 1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylpyrazol-4-yl)-(4-methylpiperidin-2-yl)methanol is sourced from PubChem (CID 79584203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).