1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol

C13H19NO — CID 121357629

IUPAC1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol
SMILESCC(C)C(O)N1CCCc2ccccc21
InChIInChI=1S/C13H19NO/c1-10(2)13(15)14-9-5-7-11-6-3-4-8-12(11)14/h3-4,6,8,10,13,15H,5,7,9H2,1-2H3
InChIKeyWAWXYLZECVOPPK-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.41
Rot. Bonds2

About 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol

1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol (PubChem CID 121357629) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol
PubChem CID121357629
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol
SMILESCC(C)C(O)N1CCCc2ccccc21
InChIInChI=1S/C13H19NO/c1-10(2)13(15)14-9-5-7-11-6-3-4-8-12(11)14/h3-4,6,8,10,13,15H,5,7,9H2,1-2H3
InChIKeyWAWXYLZECVOPPK-UHFFFAOYSA-N
XLogP2.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-bis(3,4-dihydro-2H-quinolin-1-yl)pentan-3-one
CID 151944573
(2R)-2-(3,4-dihydro-2H-quinolin-1-yl)propanoic acid
CID 42223767
2-(3,4-dihydro-2H-quinolin-1-yl)-3-methylbutanoyl chloride
CID 82041996
2-(3,4-dihydro-2H-quinolin-1-yl)propanoyl chloride
CID 12730427
2-(3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpropan-1-amine
CID 62425260
2-[1-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]phenol
CID 82980720
(1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanol
CID 55182824
2-(3,4-dihydro-2H-quinolin-1-yl)butanamide
CID 62901418
4-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
CID 62425766
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(propan-2-ylcarbamoyl)propanamide
CID 51242293
2-(3,4-dihydro-2H-quinolin-1-yl)-2-phenylethanol
CID 155093221
benzyl 2-(3,4-dihydro-2H-quinolin-1-yl)propanoate
CID 139697216

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol?
The IUPAC name of 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol (CID 121357629) is 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol?
The canonical SMILES for 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol is CC(C)C(O)N1CCCc2ccccc21.
What is the InChIKey of 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol?
The InChIKey is WAWXYLZECVOPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(2)13(15)14-9-5-7-11-6-3-4-8-12(11)14/h3-4,6,8,10,13,15H,5,7,9H2,1-2H3.
What are the key properties of 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol?
1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol has a molecular weight of 205.30 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 121357629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).