(4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol

C11H12ClN3O — CID 114643644

IUPAC(4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol
SMILESCc1ccnc(C(O)c2c(Cl)cnn2C)c1
InChIInChI=1S/C11H12ClN3O/c1-7-3-4-13-9(5-7)11(16)10-8(12)6-14-15(10)2/h3-6,11,16H,1-2H3
InChIKeyQZHYUXHQXZGTJN-UHFFFAOYSA-N
MW237.69 g/mol
LogP1.86
Rot. Bonds2

About (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol

(4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol (PubChem CID 114643644) has the molecular formula C11H12ClN3O and a molecular weight of 237.69 g/mol. Its IUPAC name is (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol.

Molecular Properties

Compound Name(4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol
PubChem CID114643644
Molecular FormulaC11H12ClN3O
Molecular Weight237.69 g/mol
Exact Mass237.07
IUPAC Name(4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol
SMILESCc1ccnc(C(O)c2c(Cl)cnn2C)c1
InChIInChI=1S/C11H12ClN3O/c1-7-3-4-13-9(5-7)11(16)10-8(12)6-14-15(10)2/h3-6,11,16H,1-2H3
InChIKeyQZHYUXHQXZGTJN-UHFFFAOYSA-N
XLogP1.86
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-chloro-4-methylphenyl)-(4-chloro-1-methylpyrazol-5-yl)methanol
CID 106859553
(4-chloro-1-methylpyrazol-5-yl)-(5-chloro-2-pyridinyl)methanol
CID 114644889
(4-chloro-1-methylpyrazol-5-yl)-(2,5-dichlorothiophen-3-yl)methanol
CID 107969920
(4-chloro-1-methylpyrazol-5-yl)-(3-fluoro-2-pyridinyl)methanol
CID 114645125
(4-chloro-1-methylpyrazol-5-yl)-(4-fluoro-2-methylphenyl)methanol
CID 114635377
1-(4-chloro-1-methylpyrazol-5-yl)-2-(4-methylphenyl)ethanol
CID 114643322
[(4-bromo-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methyl]hydrazine
CID 105220041
(1S)-1-(4-methyl-2-pyridinyl)ethanol
CID 64712746
1-(4-chloro-1-methylpyrazol-5-yl)-N-methyl-1-(2-methyl-4-pyridinyl)methanamine
CID 106755909
(4-chloro-1-methylpyrazol-5-yl)-(3-methoxy-4-pyridinyl)methanol
CID 105066457
(2-bromo-4-fluorophenyl)-(4-chloro-1-methylpyrazol-5-yl)methanol
CID 115836734
(3-bromo-5-chlorophenyl)-(4-chloro-1-methylpyrazol-5-yl)methanol
CID 107947833

Frequently Asked Questions

What is the IUPAC name of (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol?
The IUPAC name of (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol (CID 114643644) is (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol.
What is the SMILES notation for (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol?
The canonical SMILES for (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol is Cc1ccnc(C(O)c2c(Cl)cnn2C)c1.
What is the InChIKey of (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol?
The InChIKey is QZHYUXHQXZGTJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3O/c1-7-3-4-13-9(5-7)11(16)10-8(12)6-14-15(10)2/h3-6,11,16H,1-2H3.
What are the key properties of (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol?
(4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol has a molecular weight of 237.69 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-1-methylpyrazol-5-yl)-(4-methyl-2-pyridinyl)methanol is sourced from PubChem (CID 114643644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).