2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine

C17H17N3O — CID 81229719

IUPAC2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine
SMILESCOc1ccc(CC(N)c2cccc3ncccc23)cn1
InChIInChI=1S/C17H17N3O/c1-21-17-8-7-12(11-20-17)10-15(18)13-4-2-6-16-14(13)5-3-9-19-16/h2-9,11,15H,10,18H2,1H3
InChIKeyPJTXOSDQNXENJZ-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.88
Rot. Bonds4

About 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine

2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine (PubChem CID 81229719) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine.

Molecular Properties

Compound Name2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine
PubChem CID81229719
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine
SMILESCOc1ccc(CC(N)c2cccc3ncccc23)cn1
InChIInChI=1S/C17H17N3O/c1-21-17-8-7-12(11-20-17)10-15(18)13-4-2-6-16-14(13)5-3-9-19-16/h2-9,11,15H,10,18H2,1H3
InChIKeyPJTXOSDQNXENJZ-UHFFFAOYSA-N
XLogP2.88
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenyl)-1-quinolin-5-ylethanamine
CID 81227594
1-quinolin-5-ylethane-1,2-diamine
CID 55275195
(1R)-1-quinolin-5-ylethane-1,2-diamine
CID 66516625
3-methoxy-3-methyl-1-quinolin-5-ylbutan-1-amine
CID 103028668
2-(furan-3-yl)-1-quinolin-5-ylethanamine
CID 105177642
2-(2,6-dichlorophenyl)-1-quinolin-5-ylethanamine
CID 81227860
(1R)-1-quinolin-5-ylethanamine
CID 55277010
4-methyl-1-quinolin-5-ylpentan-1-amine
CID 81232092
2-(3-bromo-5-fluorophenyl)-1-quinolin-5-ylethanamine
CID 105169391
2-(4-methyl-1,3-thiazol-2-yl)-1-quinolin-5-ylethanamine
CID 81231313
N',N'-dimethyl-1-quinolin-5-ylpropane-1,3-diamine
CID 113291189
2-tert-butylsulfanyl-1-quinolin-5-ylethanamine
CID 81231907

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine?
The IUPAC name of 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine (CID 81229719) is 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine.
What is the SMILES notation for 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine?
The canonical SMILES for 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine is COc1ccc(CC(N)c2cccc3ncccc23)cn1.
What is the InChIKey of 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine?
The InChIKey is PJTXOSDQNXENJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-21-17-8-7-12(11-20-17)10-15(18)13-4-2-6-16-14(13)5-3-9-19-16/h2-9,11,15H,10,18H2,1H3.
What are the key properties of 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine?
2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine has a molecular weight of 279.34 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-3-pyridinyl)-1-quinolin-5-ylethanamine is sourced from PubChem (CID 81229719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).