2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol

C15H20N2O — CID 113345069

IUPAC2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol
SMILESCC(C)N(CCO)Cc1cnc2ccccc2c1
InChIInChI=1S/C15H20N2O/c1-12(2)17(7-8-18)11-13-9-14-5-3-4-6-15(14)16-10-13/h3-6,9-10,12,18H,7-8,11H2,1-2H3
InChIKeyBHHBBXDEGOGFJZ-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.44
Rot. Bonds5

About 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol

2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol (PubChem CID 113345069) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol
PubChem CID113345069
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol
SMILESCC(C)N(CCO)Cc1cnc2ccccc2c1
InChIInChI=1S/C15H20N2O/c1-12(2)17(7-8-18)11-13-9-14-5-3-4-6-15(14)16-10-13/h3-6,9-10,12,18H,7-8,11H2,1-2H3
InChIKeyBHHBBXDEGOGFJZ-UHFFFAOYSA-N
XLogP2.44
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-quinolin-3-ylethanol
CID 53403774
3-(2-methylpropyl)quinoline
CID 12072851
1-(furan-2-yl)-N-methyl-N-(quinolin-3-ylmethyl)methanamine
CID 23936129
N-(quinolin-3-ylmethyl)ethanamine
CID 16640553
1-(quinolin-3-ylmethylamino)ethanol
CID 143559456
2-[(6-hydrazinyl-3-pyridinyl)methyl-propan-2-ylamino]ethanol
CID 62246484
2-[1,2-oxazol-4-ylmethyl(propan-2-yl)amino]ethanol
CID 62020780
2-methyl-3-quinolin-3-ylpropan-1-amine
CID 64664749
N-methyl-2-(4-methylphenyl)-N-(quinolin-3-ylmethyl)propanamide
CID 91781862
3-ethylquinoline;quinoline
CID 174966721
3-(4-phenylpentyl)quinoline
CID 158257527
2-methyl-N-(quinolin-3-ylmethyl)propanamide
CID 110733747

Frequently Asked Questions

What is the IUPAC name of 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol?
The IUPAC name of 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol (CID 113345069) is 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol is CC(C)N(CCO)Cc1cnc2ccccc2c1.
What is the InChIKey of 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol?
The InChIKey is BHHBBXDEGOGFJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-12(2)17(7-8-18)11-13-9-14-5-3-4-6-15(14)16-10-13/h3-6,9-10,12,18H,7-8,11H2,1-2H3.
What are the key properties of 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol?
2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol has a molecular weight of 244.34 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol is sourced from PubChem (CID 113345069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).