5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol

C17H24N2O — CID 133402239

IUPAC5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol
SMILESCCc1cc(NCC(C)CC(C)O)c2ccccc2n1
InChIInChI=1S/C17H24N2O/c1-4-14-10-17(18-11-12(2)9-13(3)20)15-7-5-6-8-16(15)19-14/h5-8,10,12-13,20H,4,9,11H2,1-3H3,(H,18,19)
InChIKeyVMKPYLMZXMGBBF-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.62
Rot. Bonds6

About 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol

5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol (PubChem CID 133402239) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol.

Molecular Properties

Compound Name5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol
PubChem CID133402239
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol
SMILESCCc1cc(NCC(C)CC(C)O)c2ccccc2n1
InChIInChI=1S/C17H24N2O/c1-4-14-10-17(18-11-12(2)9-13(3)20)15-7-5-6-8-16(15)19-14/h5-8,10,12-13,20H,4,9,11H2,1-3H3,(H,18,19)
InChIKeyVMKPYLMZXMGBBF-UHFFFAOYSA-N
XLogP3.62
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-ethylquinolin-4-yl)amino]-1-(oxan-4-yl)ethanol
CID 133402118
2-ethyl-N-[2-(4-methylpiperazin-1-yl)propyl]quinolin-4-amine
CID 133401112
N-(2-methylbutyl)quinolin-4-amine
CID 62694785
4-[(2-hydroxy-3-methylpentyl)amino]quinoline-2-carbonitrile
CID 133352700
2-N-methyl-1-N-(2-pentylquinolin-4-yl)-2-N-phenylpropane-1,2-diamine
CID 166383106
N-(2-methylpropyl)-2-[(2-propylquinolin-4-yl)amino]acetamide
CID 133405225
2-ethyl-N-[2-(4-methylpyrazol-1-yl)ethyl]quinolin-4-amine
CID 133401471
4-[2-(dimethylamino)propylamino]quinoline-2-carboxylic acid
CID 63377739
N-[(2R,4S)-4-hydroxy-2-methylpentyl]-2-methylquinoline-4-carboxamide
CID 95775157
2-ethyl-4-propan-2-ylquinoline
CID 144871804
2-ethyl-N-[3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propyl]quinolin-4-amine
CID 133405040
1-[(2-methylquinolin-5-yl)amino]propan-2-ol
CID 68606423

Frequently Asked Questions

What is the IUPAC name of 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol?
The IUPAC name of 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol (CID 133402239) is 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol.
What is the SMILES notation for 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol?
The canonical SMILES for 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol is CCc1cc(NCC(C)CC(C)O)c2ccccc2n1.
What is the InChIKey of 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol?
The InChIKey is VMKPYLMZXMGBBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-4-14-10-17(18-11-12(2)9-13(3)20)15-7-5-6-8-16(15)19-14/h5-8,10,12-13,20H,4,9,11H2,1-3H3,(H,18,19).
What are the key properties of 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol?
5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol has a molecular weight of 272.39 g/mol, XLogP of 3.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol is sourced from PubChem (CID 133402239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).