1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol

C15H18N2O2 — CID 107330437

IUPAC1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol
SMILESOC(c1ccnn1-c1ccccc1)C1(O)CCCC1
InChIInChI=1S/C15H18N2O2/c18-14(15(19)9-4-5-10-15)13-8-11-16-17(13)12-6-2-1-3-7-12/h1-3,6-8,11,14,18-19H,4-5,9-10H2
InChIKeyBMRDWPURZBVLTB-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.21
Rot. Bonds3

About 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol

1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol (PubChem CID 107330437) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol
PubChem CID107330437
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol
SMILESOC(c1ccnn1-c1ccccc1)C1(O)CCCC1
InChIInChI=1S/C15H18N2O2/c18-14(15(19)9-4-5-10-15)13-8-11-16-17(13)12-6-2-1-3-7-12/h1-3,6-8,11,14,18-19H,4-5,9-10H2
InChIKeyBMRDWPURZBVLTB-UHFFFAOYSA-N
XLogP2.21
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[hydroxy-(2-methylpyrazol-3-yl)methyl]cycloheptan-1-ol
CID 103451942
1-(2-phenylpyrazol-3-yl)cyclobutan-1-ol
CID 107329942
2,2-difluoro-1-(2-phenylpyrazol-3-yl)ethanol
CID 107330398
2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butan-1-ol
CID 107332293
(2-methylcyclopropyl)-(2-phenylpyrazol-3-yl)methanol
CID 107330350
2-chloro-2,2-difluoro-1-(2-phenylpyrazol-3-yl)ethanol
CID 107330397
(2-aminophenyl)-(2-phenylpyrazol-3-yl)methanol
CID 107330329
3,3,3-trifluoro-1-(2-phenylpyrazol-3-yl)propan-1-ol
CID 107330304
(2-phenylpyrazol-3-yl)-thiophen-2-ylmethanol
CID 107329836
2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol
CID 107330353
[1-(dimethylamino)cyclopentyl]-(2-phenylpyrazol-3-yl)methanone
CID 107330172
1-methyl-4-(2-phenylpyrazol-3-yl)piperidin-4-ol
CID 107329806

Frequently Asked Questions

What is the IUPAC name of 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol (CID 107330437) is 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol is OC(c1ccnn1-c1ccccc1)C1(O)CCCC1.
What is the InChIKey of 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol?
The InChIKey is BMRDWPURZBVLTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c18-14(15(19)9-4-5-10-15)13-8-11-16-17(13)12-6-2-1-3-7-12/h1-3,6-8,11,14,18-19H,4-5,9-10H2.
What are the key properties of 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol?
1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol has a molecular weight of 258.32 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[hydroxy-(2-phenylpyrazol-3-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 107330437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).