3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol

C15H20N2O — CID 66089220

IUPAC3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol
SMILESCC(CCO)CNCc1cccc2cccnc12
InChIInChI=1S/C15H20N2O/c1-12(7-9-18)10-16-11-14-5-2-4-13-6-3-8-17-15(13)14/h2-6,8,12,16,18H,7,9-11H2,1H3
InChIKeyRFQAISZNDIFUGA-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.34
Rot. Bonds6

About 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol

3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol (PubChem CID 66089220) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol.

Molecular Properties

Compound Name3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol
PubChem CID66089220
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol
SMILESCC(CCO)CNCc1cccc2cccnc12
InChIInChI=1S/C15H20N2O/c1-12(7-9-18)10-16-11-14-5-2-4-13-6-3-8-17-15(13)14/h2-6,8,12,16,18H,7,9-11H2,1H3
InChIKeyRFQAISZNDIFUGA-UHFFFAOYSA-N
XLogP2.34
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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

3-[[(4-hydroxy-2-methylbutyl)amino]methyl]pyridine-2-carbonitrile
CID 66090692
2-phenyl-N-(quinolin-8-ylmethyl)propan-1-amine
CID 43182084
1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol
CID 169240625
1-phenyl-2-(quinolin-8-ylmethylamino)ethanol
CID 43394632
5-(quinolin-8-ylmethylamino)pentan-1-ol
CID 81427382
2-(quinolin-8-ylmethylamino)propanoic acid
CID 43467362
1-(2-quinolin-8-ylethylamino)propan-2-ol
CID 81428765
2-methyl-3-(quinolin-8-ylmethylamino)butan-1-ol
CID 115644489
1-quinolin-8-ylpropan-2-amine
CID 63968867
1-(2,3-dimethylphenyl)-N-(quinolin-8-ylmethyl)methanamine
CID 78980832
N-(quinolin-8-ylmethyl)butan-1-amine
CID 28613793
2-(quinolin-8-ylmethylamino)acetic acid
CID 43135065

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol?
The IUPAC name of 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol (CID 66089220) is 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol.
What is the SMILES notation for 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol?
The canonical SMILES for 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol is CC(CCO)CNCc1cccc2cccnc12.
What is the InChIKey of 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol?
The InChIKey is RFQAISZNDIFUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-12(7-9-18)10-16-11-14-5-2-4-13-6-3-8-17-15(13)14/h2-6,8,12,16,18H,7,9-11H2,1H3.
What are the key properties of 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol?
3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol has a molecular weight of 244.34 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol is sourced from PubChem (CID 66089220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).