(1R)-1-(4-methylquinolin-2-yl)butan-1-ol

C14H17NO — CID 104969389

IUPAC(1R)-1-(4-methylquinolin-2-yl)butan-1-ol
SMILESCCC[C@@H](O)c1cc(C)c2ccccc2n1
InChIInChI=1S/C14H17NO/c1-3-6-14(16)13-9-10(2)11-7-4-5-8-12(11)15-13/h4-5,7-9,14,16H,3,6H2,1-2H3/t14-/m1/s1
InChIKeyJXEJRIZSDLKDHW-CQSZACIVSA-N
MW215.30 g/mol
LogP3.38
Rot. Bonds3

About (1R)-1-(4-methylquinolin-2-yl)butan-1-ol

(1R)-1-(4-methylquinolin-2-yl)butan-1-ol (PubChem CID 104969389) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is (1R)-1-(4-methylquinolin-2-yl)butan-1-ol.

Molecular Properties

Compound Name(1R)-1-(4-methylquinolin-2-yl)butan-1-ol
PubChem CID104969389
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name(1R)-1-(4-methylquinolin-2-yl)butan-1-ol
SMILESCCC[C@@H](O)c1cc(C)c2ccccc2n1
InChIInChI=1S/C14H17NO/c1-3-6-14(16)13-9-10(2)11-7-4-5-8-12(11)15-13/h4-5,7-9,14,16H,3,6H2,1-2H3/t14-/m1/s1
InChIKeyJXEJRIZSDLKDHW-CQSZACIVSA-N
XLogP3.38
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol
CID 114754836
2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol
CID 114754909
1-(4-methylquinolin-2-yl)-4-(oxolan-2-yl)butan-1-ol
CID 114754924
2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol
CID 114754949
N-ethyl-1-(4-methylquinolin-2-yl)ethanamine
CID 114755257
3-methyl-1-(4-methylquinolin-2-yl)-N-propylbut-3-en-1-amine
CID 114755354
(2-ethylpyrazol-3-yl)-(4-methylquinolin-2-yl)methanol
CID 114754847
[4-methyl-1-(4-methylquinolin-2-yl)pent-4-enyl]hydrazine
CID 105279669
(4-methoxyphenyl)-(4-methylquinolin-2-yl)methanol
CID 114754870
(3,4-difluorophenyl)-(4-methylquinolin-2-yl)methanol
CID 114754840
1-(4-methylquinolin-2-yl)pent-4-en-1-amine
CID 114755015
1-(2-methylquinolin-4-yl)pentan-1-ol
CID 79235698

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-methylquinolin-2-yl)butan-1-ol?
The IUPAC name of (1R)-1-(4-methylquinolin-2-yl)butan-1-ol (CID 104969389) is (1R)-1-(4-methylquinolin-2-yl)butan-1-ol.
What is the SMILES notation for (1R)-1-(4-methylquinolin-2-yl)butan-1-ol?
The canonical SMILES for (1R)-1-(4-methylquinolin-2-yl)butan-1-ol is CCC[C@@H](O)c1cc(C)c2ccccc2n1.
What is the InChIKey of (1R)-1-(4-methylquinolin-2-yl)butan-1-ol?
The InChIKey is JXEJRIZSDLKDHW-CQSZACIVSA-N. The full InChI is InChI=1S/C14H17NO/c1-3-6-14(16)13-9-10(2)11-7-4-5-8-12(11)15-13/h4-5,7-9,14,16H,3,6H2,1-2H3/t14-/m1/s1.
What are the key properties of (1R)-1-(4-methylquinolin-2-yl)butan-1-ol?
(1R)-1-(4-methylquinolin-2-yl)butan-1-ol has a molecular weight of 215.30 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-methylquinolin-2-yl)butan-1-ol is sourced from PubChem (CID 104969389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).