[3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine

C17H17N3O — CID 62893676

IUPAC[3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine
SMILESCc1ccc2cccc(OCc3cccnc3CN)c2n1
InChIInChI=1S/C17H17N3O/c1-12-7-8-13-4-2-6-16(17(13)20-12)21-11-14-5-3-9-19-15(14)10-18/h2-9H,10-11,18H2,1H3
InChIKeyYHTOXAMJEAAQQW-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.98
Rot. Bonds4

About [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine

[3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine (PubChem CID 62893676) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine
PubChem CID62893676
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name[3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine
SMILESCc1ccc2cccc(OCc3cccnc3CN)c2n1
InChIInChI=1S/C17H17N3O/c1-12-7-8-13-4-2-6-16(17(13)20-12)21-11-14-5-3-9-19-15(14)10-18/h2-9H,10-11,18H2,1H3
InChIKeyYHTOXAMJEAAQQW-UHFFFAOYSA-N
XLogP2.98
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 ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine
CID 63887490
[2-(quinolin-8-yloxymethyl)phenyl]methanamine
CID 28824796
8-[(6-ethyl-2-pyridinyl)methoxy]-2-methylquinoline
CID 163741532
8-[(5-bromo-2-pyridinyl)methoxy]-2-methylquinoline
CID 104809806
[3-[(4-methylphenoxy)methyl]-2-pyridinyl]methanamine
CID 62893839
2-methyl-8-[[4-(trifluoromethyl)phenyl]methoxy]quinoline
CID 67980760
3-bromo-2-[(2-methylquinolin-8-yl)oxymethyl]aniline
CID 43352151
8-[(3,6-dichloro-2-pyridinyl)methoxy]-2-methylquinoline
CID 62886311
[4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]hydrazine
CID 62464151
2-(2-methylquinolin-8-yl)oxyethanethioamide
CID 43352184
[3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine
CID 103174319
6-methyl-3-(quinolin-8-ylmethoxy)pyridine-2-carbaldehyde
CID 78929085

Frequently Asked Questions

What is the IUPAC name of [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine?
The IUPAC name of [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine (CID 62893676) is [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine?
The canonical SMILES for [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine is Cc1ccc2cccc(OCc3cccnc3CN)c2n1.
What is the InChIKey of [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine?
The InChIKey is YHTOXAMJEAAQQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-12-7-8-13-4-2-6-16(17(13)20-12)21-11-14-5-3-9-19-15(14)10-18/h2-9H,10-11,18H2,1H3.
What are the key properties of [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine?
[3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine has a molecular weight of 279.34 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 62893676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).