[4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine

C17H17N3O — CID 63887490

IUPAC[4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine
SMILESCc1ccc2cccc(OCc3ccnc(CN)c3)c2n1
InChIInChI=1S/C17H17N3O/c1-12-5-6-14-3-2-4-16(17(14)20-12)21-11-13-7-8-19-15(9-13)10-18/h2-9H,10-11,18H2,1H3
InChIKeyYOINESPMMPCTHH-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.98
Rot. Bonds4

About [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine

[4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine (PubChem CID 63887490) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine
PubChem CID63887490
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name[4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine
SMILESCc1ccc2cccc(OCc3ccnc(CN)c3)c2n1
InChIInChI=1S/C17H17N3O/c1-12-5-6-14-3-2-4-16(17(14)20-12)21-11-13-7-8-19-15(9-13)10-18/h2-9H,10-11,18H2,1H3
InChIKeyYOINESPMMPCTHH-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]hydrazine
CID 62464151
[3-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine
CID 62893676
[4-[(2-bromophenoxy)methyl]-2-pyridinyl]methanamine
CID 63887682
8-[(6-ethyl-2-pyridinyl)methoxy]-2-methylquinoline
CID 163741532
2-methyl-8-[[4-(trifluoromethyl)phenyl]methoxy]quinoline
CID 67980760
[4-[(2-propoxyphenoxy)methyl]-2-pyridinyl]methanamine
CID 63888254
8-[(5-bromo-2-pyridinyl)methoxy]-2-methylquinoline
CID 104809806
3-bromo-2-[(2-methylquinolin-8-yl)oxymethyl]aniline
CID 43352151
8-[(4-chloro-6-methylpyrimidin-2-yl)methoxy]-2-methylquinoline
CID 80656920
[5-(2-methylquinolin-8-yl)oxy-2-pyridinyl]methanamine
CID 115487171
2-(2-methylquinolin-8-yl)oxyethanethioamide
CID 43352184
[4-[[2-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]methanamine
CID 63889622

Frequently Asked Questions

What is the IUPAC name of [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine?
The IUPAC name of [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine (CID 63887490) is [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine?
The canonical SMILES for [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine is Cc1ccc2cccc(OCc3ccnc(CN)c3)c2n1.
What is the InChIKey of [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine?
The InChIKey is YOINESPMMPCTHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-12-5-6-14-3-2-4-16(17(14)20-12)21-11-13-7-8-19-15(9-13)10-18/h2-9H,10-11,18H2,1H3.
What are the key properties of [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine?
[4-[(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 [4-[(2-methylquinolin-8-yl)oxymethyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 63887490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).