(5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol

C15H19N3O — CID 116505787

IUPAC(5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol
SMILESCn1ncc(C(O)c2ccc(C3CCC3)cc2)c1N
InChIInChI=1S/C15H19N3O/c1-18-15(16)13(9-17-18)14(19)12-7-5-11(6-8-12)10-3-2-4-10/h5-10,14,19H,2-4,16H2,1H3
InChIKeyZOCDZMXNBCLVDF-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.35
Rot. Bonds3

About (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol

(5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol (PubChem CID 116505787) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol.

Molecular Properties

Compound Name(5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol
PubChem CID116505787
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name(5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol
SMILESCn1ncc(C(O)c2ccc(C3CCC3)cc2)c1N
InChIInChI=1S/C15H19N3O/c1-18-15(16)13(9-17-18)14(19)12-7-5-11(6-8-12)10-3-2-4-10/h5-10,14,19H,2-4,16H2,1H3
InChIKeyZOCDZMXNBCLVDF-UHFFFAOYSA-N
XLogP2.35
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(5-amino-1-methylpyrazol-4-yl)-(4-methylphenyl)methanol
CID 65362027
(5-amino-1-methylpyrazol-4-yl)-(4-methoxyphenyl)methanol
CID 65362246
(4-cyclobutylphenyl)-pyridazin-4-ylmethanol
CID 105129046
(4-cyclobutylphenyl)-(3-propylimidazol-4-yl)methanol
CID 116505404
(5-bromo-2-pyridinyl)-(4-cyclobutylphenyl)methanol
CID 116505490
(4-bromo-2-methylphenyl)-(4-cyclobutylphenyl)methanol
CID 115836232
4-(5-cyclopentyl-2-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117431595
(4-cyclopropylphenyl)-(1-ethylpyrazol-4-yl)methanol
CID 79980499
(2-bromo-5-fluorophenyl)-(4-cyclobutylphenyl)methanol
CID 115836289
(3-chloro-2-fluorophenyl)-(4-cyclobutylphenyl)methanol
CID 116505775
1-methyl-4-[4-(1-methylazetidin-3-yl)phenyl]pyrazol-5-amine
CID 117358254
(5-amino-1-methylpyrazol-4-yl)-(3-bromo-2,4-dimethoxyphenyl)methanol
CID 103523206

Frequently Asked Questions

What is the IUPAC name of (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol?
The IUPAC name of (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol (CID 116505787) is (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol.
What is the SMILES notation for (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol?
The canonical SMILES for (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol is Cn1ncc(C(O)c2ccc(C3CCC3)cc2)c1N.
What is the InChIKey of (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol?
The InChIKey is ZOCDZMXNBCLVDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18-15(16)13(9-17-18)14(19)12-7-5-11(6-8-12)10-3-2-4-10/h5-10,14,19H,2-4,16H2,1H3.
What are the key properties of (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol?
(5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol has a molecular weight of 257.34 g/mol, XLogP of 2.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol is sourced from PubChem (CID 116505787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).