1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol

C19H24N4O — CID 133437963

IUPAC1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol
SMILESCCc1c(C)nc2ccccc2c1NCC(C)(O)c1cnn(C)c1
InChIInChI=1S/C19H24N4O/c1-5-15-13(2)22-17-9-7-6-8-16(17)18(15)20-12-19(3,24)14-10-21-23(4)11-14/h6-11,24H,5,12H2,1-4H3,(H,20,22)
InChIKeyJFYWMVXYLGQNNH-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.16
Rot. Bonds5

About 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol

1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol (PubChem CID 133437963) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol.

Molecular Properties

Compound Name1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol
PubChem CID133437963
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol
SMILESCCc1c(C)nc2ccccc2c1NCC(C)(O)c1cnn(C)c1
InChIInChI=1S/C19H24N4O/c1-5-15-13(2)22-17-9-7-6-8-16(17)18(15)20-12-19(3,24)14-10-21-23(4)11-14/h6-11,24H,5,12H2,1-4H3,(H,20,22)
InChIKeyJFYWMVXYLGQNNH-UHFFFAOYSA-N
XLogP3.16
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(3-ethyl-2-methylquinolin-4-yl)amino]-3,3-dimethylbutan-1-ol
CID 133438117
1-(methylamino)-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 66036984
2-(1-methylpyrazol-4-yl)-1-[(5-methylpyrimidin-2-yl)amino]propan-2-ol
CID 133403121
1-[(4-ethylphenyl)methylamino]-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 111457689
1-[(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 75422132
N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
CID 166202902
N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
CID 166382384
N-[2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]-2-phenylsulfanylacetamide
CID 111458525
2-(1-methylpyrazol-4-yl)-1-(propan-2-ylamino)propan-2-ol
CID 66039398
2-(1-methylpyrazol-4-yl)-1-[(2-phenyl-1,3-thiazol-4-yl)methylamino]propan-2-ol
CID 111457694
1-[2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]-3-(2-phenylbutyl)urea
CID 111459062
(2R)-1-[[(1S)-1-(2-fluorophenyl)propyl]amino]-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 99852141

Frequently Asked Questions

What is the IUPAC name of 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol?
The IUPAC name of 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol (CID 133437963) is 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol.
What is the SMILES notation for 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol?
The canonical SMILES for 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol is CCc1c(C)nc2ccccc2c1NCC(C)(O)c1cnn(C)c1.
What is the InChIKey of 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol?
The InChIKey is JFYWMVXYLGQNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-5-15-13(2)22-17-9-7-6-8-16(17)18(15)20-12-19(3,24)14-10-21-23(4)11-14/h6-11,24H,5,12H2,1-4H3,(H,20,22).
What are the key properties of 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol?
1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol has a molecular weight of 324.43 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol is sourced from PubChem (CID 133437963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).