(2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol

C8H11N5O — CID 130521702

IUPAC(2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol
SMILESCn1cc(C(O)c2ccnn2C)nn1
InChIInChI=1S/C8H11N5O/c1-12-5-6(10-11-12)8(14)7-3-4-9-13(7)2/h3-5,8,14H,1-2H3
InChIKeyCPINZOBRZPEYHN-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.37
Rot. Bonds2

About (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol

(2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol (PubChem CID 130521702) has the molecular formula C8H11N5O and a molecular weight of 193.21 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol.

Molecular Properties

Compound Name(2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol
PubChem CID130521702
Molecular FormulaC8H11N5O
Molecular Weight193.21 g/mol
Exact Mass193.10
IUPAC Name(2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol
SMILESCn1cc(C(O)c2ccnn2C)nn1
InChIInChI=1S/C8H11N5O/c1-12-5-6(10-11-12)8(14)7-3-4-9-13(7)2/h3-5,8,14H,1-2H3
InChIKeyCPINZOBRZPEYHN-UHFFFAOYSA-N
XLogP-0.37
TPSA68.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

furan-3-yl-(1-methyltriazol-4-yl)methanol
CID 130521695
(2-methylthiophen-3-yl)-(1-methyltriazol-4-yl)methanol
CID 130521768
(2,4-dichlorophenyl)-(1-methyltriazol-4-yl)methanol
CID 166178328
(2-methylpyrazol-3-yl)-(4-methylthiadiazol-5-yl)methanol
CID 105098276
furan-3-yl-(2-methylpyrazol-3-yl)methanol
CID 63960730
(3,5-dimethylphenyl)-(2-methylpyrazol-3-yl)methanol
CID 63960732
(4-chlorophenyl)-(2-methylpyrazol-3-yl)methanol
CID 11550333
2,3-dihydroxy-3-(2-methylpyrazol-3-yl)propanoic acid
CID 170825003
(1R)-2,2,2-trifluoro-1-(1-methyltriazol-4-yl)ethanol
CID 130602732
(4-ethylphenyl)-(2-methylpyrazol-3-yl)methanol
CID 63962198
2-methoxy-1-(1-methyltriazol-4-yl)propan-1-ol
CID 130602705
(2-fluoro-3-methoxyphenyl)-(1-methyltriazol-4-yl)methanol
CID 112735964

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol?
The IUPAC name of (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol (CID 130521702) is (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol.
What is the SMILES notation for (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol?
The canonical SMILES for (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol is Cn1cc(C(O)c2ccnn2C)nn1.
What is the InChIKey of (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol?
The InChIKey is CPINZOBRZPEYHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O/c1-12-5-6(10-11-12)8(14)7-3-4-9-13(7)2/h3-5,8,14H,1-2H3.
What are the key properties of (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol?
(2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol has a molecular weight of 193.21 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazol-3-yl)-(1-methyltriazol-4-yl)methanol is sourced from PubChem (CID 130521702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).