(3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol

C11H12ClN3O — CID 103443527

IUPAC(3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol
SMILESCCn1nccc1C(O)c1ncccc1Cl
InChIInChI=1S/C11H12ClN3O/c1-2-15-9(5-7-14-15)11(16)10-8(12)4-3-6-13-10/h3-7,11,16H,2H2,1H3
InChIKeyLHDCCKPKYLGVBU-UHFFFAOYSA-N
MW237.69 g/mol
LogP2.03
Rot. Bonds3

About (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol

(3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol (PubChem CID 103443527) has the molecular formula C11H12ClN3O and a molecular weight of 237.69 g/mol. Its IUPAC name is (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol
PubChem CID103443527
Molecular FormulaC11H12ClN3O
Molecular Weight237.69 g/mol
Exact Mass237.07
IUPAC Name(3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol
SMILESCCn1nccc1C(O)c1ncccc1Cl
InChIInChI=1S/C11H12ClN3O/c1-2-15-9(5-7-14-15)11(16)10-8(12)4-3-6-13-10/h3-7,11,16H,2H2,1H3
InChIKeyLHDCCKPKYLGVBU-UHFFFAOYSA-N
XLogP2.03
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-ethylpyrazol-3-yl)-isoquinolin-1-ylmethanol
CID 63976354
(4-chloro-3-fluorophenyl)-(2-ethylpyrazol-3-yl)methanol
CID 63975266
(5-bromofuran-2-yl)-(2-ethylpyrazol-3-yl)methanol
CID 63976104
(3-chloro-4-methylphenyl)-(3-chloro-2-pyridinyl)methanol
CID 107560175
[(2-ethylpyrazol-3-yl)-(3-ethyl-2-pyridinyl)methyl]hydrazine
CID 105263839
(2-ethylpyrazol-3-yl)-(3-fluorophenyl)methanol
CID 63975475
(3-ethylphenyl)-(2-ethylpyrazol-3-yl)methanol
CID 114556807
(2-ethylpyrazol-3-yl)-quinolin-3-ylmethanol
CID 114556793
2-chloro-1-(2-ethylpyrazol-3-yl)-2,2-difluoroethanol
CID 112575208
2-(2-chlorophenyl)sulfanyl-1-(2-ethylpyrazol-3-yl)ethanamine
CID 66142205
(4-bromo-1-methylpyrazol-5-yl)-(3-chloro-2-pyridinyl)methanol
CID 103443544
(2-ethylpyrazol-3-yl)-quinolin-2-ylmethanol
CID 63975926

Frequently Asked Questions

What is the IUPAC name of (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol?
The IUPAC name of (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol (CID 103443527) is (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol.
What is the SMILES notation for (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol?
The canonical SMILES for (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol is CCn1nccc1C(O)c1ncccc1Cl.
What is the InChIKey of (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol?
The InChIKey is LHDCCKPKYLGVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3O/c1-2-15-9(5-7-14-15)11(16)10-8(12)4-3-6-13-10/h3-7,11,16H,2H2,1H3.
What are the key properties of (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol?
(3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol has a molecular weight of 237.69 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-pyridinyl)-(2-ethylpyrazol-3-yl)methanol is sourced from PubChem (CID 103443527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).