2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol

C15H20N2O — CID 115644489

IUPAC2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol
SMILESCC(CO)C(C)NCc1cccc2cccnc12
InChIInChI=1S/C15H20N2O/c1-11(10-18)12(2)17-9-14-6-3-5-13-7-4-8-16-15(13)14/h3-8,11-12,17-18H,9-10H2,1-2H3
InChIKeyKZCLHLLSOZOQBJ-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.34
Rot. Bonds5

About 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol

2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol (PubChem CID 115644489) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol.

Molecular Properties

Compound Name2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol
PubChem CID115644489
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol
SMILESCC(CO)C(C)NCc1cccc2cccnc12
InChIInChI=1S/C15H20N2O/c1-11(10-18)12(2)17-9-14-6-3-5-13-7-4-8-16-15(13)14/h3-8,11-12,17-18H,9-10H2,1-2H3
InChIKeyKZCLHLLSOZOQBJ-UHFFFAOYSA-N
XLogP2.34
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(quinolin-8-ylmethylamino)propanoic acid
CID 43467362
1-iodo-3-methyl-N-(quinolin-8-ylmethyl)butan-2-amine
CID 107859459
3-methyl-2-(quinolin-8-ylmethylamino)butanoic acid
CID 43468279
(1R)-1-pyridin-4-yl-N-(quinolin-8-ylmethyl)ethanamine
CID 28644871
N-ethyl-2-(quinolin-8-ylmethylamino)propanamide
CID 43403033
1-chloro-4-methyl-N-(quinolin-8-ylmethyl)pentan-3-amine
CID 106353850
(1S)-2-methyl-1-phenyl-N-(quinolin-8-ylmethyl)propan-1-amine
CID 124823553
(1S)-1-(3-chlorophenyl)-N-(quinolin-8-ylmethyl)ethanamine
CID 28649781
1-(1-hydroxypropan-2-yl)-3-(quinolin-8-ylmethyl)urea
CID 110909300
3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol
CID 66089220
1-(3-methylpyrazin-2-yl)-N-(quinolin-8-ylmethyl)ethanamine
CID 102612589
N-(methylcarbamoyl)-2-(quinolin-8-ylmethylamino)propanamide
CID 81428182

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol?
The IUPAC name of 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol (CID 115644489) is 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol.
What is the SMILES notation for 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol?
The canonical SMILES for 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol is CC(CO)C(C)NCc1cccc2cccnc12.
What is the InChIKey of 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol?
The InChIKey is KZCLHLLSOZOQBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11(10-18)12(2)17-9-14-6-3-5-13-7-4-8-16-15(13)14/h3-8,11-12,17-18H,9-10H2,1-2H3.
What are the key properties of 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol?
2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol has a molecular weight of 244.34 g/mol, XLogP of 2.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol is sourced from PubChem (CID 115644489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).