1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol

C14H19N3O — CID 64771004

IUPAC1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
SMILESCc1cccnc1C(O)Cc1ccn(C(C)C)n1
InChIInChI=1S/C14H19N3O/c1-10(2)17-8-6-12(16-17)9-13(18)14-11(3)5-4-7-15-14/h4-8,10,13,18H,9H2,1-3H3
InChIKeyMLNNQCZXINKZEK-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.44
Rot. Bonds4

About 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol

1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol (PubChem CID 64771004) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
PubChem CID64771004
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
SMILESCc1cccnc1C(O)Cc1ccn(C(C)C)n1
InChIInChI=1S/C14H19N3O/c1-10(2)17-8-6-12(16-17)9-13(18)14-11(3)5-4-7-15-14/h4-8,10,13,18H,9H2,1-3H3
InChIKeyMLNNQCZXINKZEK-UHFFFAOYSA-N
XLogP2.44
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 64770812
2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol
CID 64785093
1-(2-methylpyrimidin-4-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 115527999
3-methyl-4-(1-propan-2-ylpyrazol-3-yl)butan-2-ol
CID 64772656
N-methyl-2-(1-propan-2-ylpyrazol-3-yl)-1-pyrimidin-2-ylethanamine
CID 64770856
(1R)-2-bromo-1-(3-methyl-2-pyridinyl)ethanol
CID 155163970
CID 155748395
CID 155748395
1-(5-bromothiophen-3-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 105103317
1-(1,5-dimethylpyrazol-3-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 114220139
2-(1-propan-2-ylpyrazol-3-yl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105103448
2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanol
CID 64904867
1-(4-cyclopropylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 79980806

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The IUPAC name of 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol (CID 64771004) is 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol.
What is the SMILES notation for 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The canonical SMILES for 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol is Cc1cccnc1C(O)Cc1ccn(C(C)C)n1.
What is the InChIKey of 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
The InChIKey is MLNNQCZXINKZEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-10(2)17-8-6-12(16-17)9-13(18)14-11(3)5-4-7-15-14/h4-8,10,13,18H,9H2,1-3H3.
What are the key properties of 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol?
1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol has a molecular weight of 245.33 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol is sourced from PubChem (CID 64771004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).