3-amino-1-quinolin-7-ylpropan-1-ol

C12H14N2O — CID 84670752

IUPAC3-amino-1-quinolin-7-ylpropan-1-ol
SMILESNCCC(O)c1ccc2cccnc2c1
InChIInChI=1S/C12H14N2O/c13-6-5-12(15)10-4-3-9-2-1-7-14-11(9)8-10/h1-4,7-8,12,15H,5-6,13H2
InChIKeyPDODXMJOSWCUMH-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.62
Rot. Bonds3

About 3-amino-1-quinolin-7-ylpropan-1-ol

3-amino-1-quinolin-7-ylpropan-1-ol (PubChem CID 84670752) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 3-amino-1-quinolin-7-ylpropan-1-ol.

Molecular Properties

Compound Name3-amino-1-quinolin-7-ylpropan-1-ol
PubChem CID84670752
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name3-amino-1-quinolin-7-ylpropan-1-ol
SMILESNCCC(O)c1ccc2cccnc2c1
InChIInChI=1S/C12H14N2O/c13-6-5-12(15)10-4-3-9-2-1-7-14-11(9)8-10/h1-4,7-8,12,15H,5-6,13H2
InChIKeyPDODXMJOSWCUMH-UHFFFAOYSA-N
XLogP1.62
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-quinolin-7-ylnonan-1-ol
CID 15658090
3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-ol
CID 105118985
3-amino-1-naphthalen-2-ylpropan-1-ol
CID 65184856
1-quinolin-7-ylpropane-1,2,3-triol
CID 170818071
2-(2-methylpropylamino)-1-quinolin-7-ylethanol
CID 81221212
2-(2-bromophenyl)-1-quinolin-7-ylethanol
CID 81220436
pyrimidin-2-yl(quinolin-7-yl)methanamine
CID 81220998
4,4,4-trifluoro-1-quinolin-6-ylbutan-1-ol
CID 64566958
cycloheptyl(quinolin-7-yl)methanol
CID 81216722
2,2-dimethyl-1-quinolin-7-ylpropan-1-amine
CID 81220535
3-amino-1-furo[3,2-b]pyridin-2-ylpropan-1-ol
CID 84772319
2,2-diethoxy-1-quinolin-7-ylethanol
CID 81220002

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-quinolin-7-ylpropan-1-ol?
The IUPAC name of 3-amino-1-quinolin-7-ylpropan-1-ol (CID 84670752) is 3-amino-1-quinolin-7-ylpropan-1-ol.
What is the SMILES notation for 3-amino-1-quinolin-7-ylpropan-1-ol?
The canonical SMILES for 3-amino-1-quinolin-7-ylpropan-1-ol is NCCC(O)c1ccc2cccnc2c1.
What is the InChIKey of 3-amino-1-quinolin-7-ylpropan-1-ol?
The InChIKey is PDODXMJOSWCUMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c13-6-5-12(15)10-4-3-9-2-1-7-14-11(9)8-10/h1-4,7-8,12,15H,5-6,13H2.
What are the key properties of 3-amino-1-quinolin-7-ylpropan-1-ol?
3-amino-1-quinolin-7-ylpropan-1-ol has a molecular weight of 202.26 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-quinolin-7-ylpropan-1-ol is sourced from PubChem (CID 84670752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).