3-amino-2-quinolin-4-ylpropan-1-ol

C12H14N2O — CID 63215939

IUPAC3-amino-2-quinolin-4-ylpropan-1-ol
SMILESNCC(CO)c1ccnc2ccccc12
InChIInChI=1S/C12H14N2O/c13-7-9(8-15)10-5-6-14-12-4-2-1-3-11(10)12/h1-6,9,15H,7-8,13H2
InChIKeyYCQVOICQCPGFFZ-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.27
Rot. Bonds3

About 3-amino-2-quinolin-4-ylpropan-1-ol

3-amino-2-quinolin-4-ylpropan-1-ol (PubChem CID 63215939) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 3-amino-2-quinolin-4-ylpropan-1-ol.

Molecular Properties

Compound Name3-amino-2-quinolin-4-ylpropan-1-ol
PubChem CID63215939
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name3-amino-2-quinolin-4-ylpropan-1-ol
SMILESNCC(CO)c1ccnc2ccccc12
InChIInChI=1S/C12H14N2O/c13-7-9(8-15)10-5-6-14-12-4-2-1-3-11(10)12/h1-6,9,15H,7-8,13H2
InChIKeyYCQVOICQCPGFFZ-UHFFFAOYSA-N
XLogP1.27
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 ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-quinolin-4-ylpropane-1,3-diol
CID 66206365
(4R)-4-amino-4-quinolin-4-ylbutan-1-ol;hydrochloride
CID 171217020
(1S)-1-quinolin-4-ylpropan-1-amine;hydrochloride
CID 171236618
(1R)-1-quinolin-4-ylbutane-1,4-diamine;hydrochloride
CID 171216978
1-quinolin-4-ylethanamine;dihydrochloride
CID 69169049
(1S)-3,3-difluoro-1-quinolin-4-ylpropan-1-amine
CID 171313405
CID 160608048
CID 160608048
1-quinolin-5-ylethane-1,2-diamine
CID 55275195
(1R)-1-quinolin-5-ylethane-1,2-diamine
CID 66516625
(1R)-3,3-difluoro-1-quinolin-4-ylpropan-1-amine;hydrochloride
CID 171314041
3-amino-2-(2,1-benzothiazol-3-yl)propan-1-ol
CID 66356179
(1R)-1-quinolin-4-ylprop-2-en-1-amine;hydrochloride
CID 171216982

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-quinolin-4-ylpropan-1-ol?
The IUPAC name of 3-amino-2-quinolin-4-ylpropan-1-ol (CID 63215939) is 3-amino-2-quinolin-4-ylpropan-1-ol.
What is the SMILES notation for 3-amino-2-quinolin-4-ylpropan-1-ol?
The canonical SMILES for 3-amino-2-quinolin-4-ylpropan-1-ol is NCC(CO)c1ccnc2ccccc12.
What is the InChIKey of 3-amino-2-quinolin-4-ylpropan-1-ol?
The InChIKey is YCQVOICQCPGFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c13-7-9(8-15)10-5-6-14-12-4-2-1-3-11(10)12/h1-6,9,15H,7-8,13H2.
What are the key properties of 3-amino-2-quinolin-4-ylpropan-1-ol?
3-amino-2-quinolin-4-ylpropan-1-ol has a molecular weight of 202.26 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-quinolin-4-ylpropan-1-ol is sourced from PubChem (CID 63215939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).