3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol

C11H18ClN3O — CID 114633980

IUPAC3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol
SMILESCCCn1ncc(Cl)c1C1(O)CCCNC1
InChIInChI=1S/C11H18ClN3O/c1-2-6-15-10(9(12)7-14-15)11(16)4-3-5-13-8-11/h7,13,16H,2-6,8H2,1H3
InChIKeyVARZYIGWYRWGPT-UHFFFAOYSA-N
MW243.74 g/mol
LogP1.52
Rot. Bonds3

About 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol

3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol (PubChem CID 114633980) has the molecular formula C11H18ClN3O and a molecular weight of 243.74 g/mol. Its IUPAC name is 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol.

Molecular Properties

Compound Name3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol
PubChem CID114633980
Molecular FormulaC11H18ClN3O
Molecular Weight243.74 g/mol
Exact Mass243.11
IUPAC Name3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol
SMILESCCCn1ncc(Cl)c1C1(O)CCCNC1
InChIInChI=1S/C11H18ClN3O/c1-2-6-15-10(9(12)7-14-15)11(16)4-3-5-13-8-11/h7,13,16H,2-6,8H2,1H3
InChIKeyVARZYIGWYRWGPT-UHFFFAOYSA-N
XLogP1.52
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.74
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-chloro-1-propylpyrazol-5-yl)-1-ethylazepan-4-ol
CID 114636201
(4-chloro-1-propylpyrazol-5-yl)-(3-methylpiperidin-3-yl)methanone
CID 114669182
1-[4-chloro-1-[2-(dimethylamino)ethyl]pyrazol-5-yl]cycloheptan-1-ol
CID 114633263
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]cyclobutan-1-ol
CID 114636731
1-(4-chloro-1-propylpyrazol-5-yl)-2-methylcyclopentan-1-ol
CID 114636173
2-(4-chloro-1-propylpyrazol-5-yl)-2-cyclopropylazepane
CID 114657376
3-(4-bromo-1-methylpyrazol-5-yl)piperidin-3-ol
CID 114633976
3-(2-propylpyrazol-3-yl)pyrrolidin-3-ol
CID 63975247
5-(4-chloro-1-propylpyrazol-5-yl)-6,7,8,9-tetrahydrobenzo[7]annulen-5-ol
CID 114633273
1-(3-propyltriazol-4-yl)cyclopentan-1-ol
CID 114684539
3-(4-chloro-1-propylpyrazol-5-yl)-2-methyloxolan-3-ol
CID 114637906
[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(3-propylpiperidin-3-yl)methanone
CID 114669197

Frequently Asked Questions

What is the IUPAC name of 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol?
The IUPAC name of 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol (CID 114633980) is 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol.
What is the SMILES notation for 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol?
The canonical SMILES for 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol is CCCn1ncc(Cl)c1C1(O)CCCNC1.
What is the InChIKey of 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol?
The InChIKey is VARZYIGWYRWGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClN3O/c1-2-6-15-10(9(12)7-14-15)11(16)4-3-5-13-8-11/h7,13,16H,2-6,8H2,1H3.
What are the key properties of 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol?
3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol has a molecular weight of 243.74 g/mol, XLogP of 1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloro-1-propylpyrazol-5-yl)piperidin-3-ol is sourced from PubChem (CID 114633980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).