[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine

C18H18N2O — CID 22148915

IUPAC[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine
SMILESCc1cc(COc2ccc(CN)cc2)c2ccccc2n1
InChIInChI=1S/C18H18N2O/c1-13-10-15(17-4-2-3-5-18(17)20-13)12-21-16-8-6-14(11-19)7-9-16/h2-10H,11-12,19H2,1H3
InChIKeyFAYOYPCEEUBFNA-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.58
Rot. Bonds4

About [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine

[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine (PubChem CID 22148915) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine.

Molecular Properties

Compound Name[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine
PubChem CID22148915
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine
SMILESCc1cc(COc2ccc(CN)cc2)c2ccccc2n1
InChIInChI=1S/C18H18N2O/c1-13-10-15(17-4-2-3-5-18(17)20-13)12-21-16-8-6-14(11-19)7-9-16/h2-10H,11-12,19H2,1H3
InChIKeyFAYOYPCEEUBFNA-UHFFFAOYSA-N
XLogP3.58
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-methylquinolin-4-yl)methoxy]benzoic acid
CID 22032775
[2-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine
CID 79234339
1-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methyl]cyclopropane-1-carboxamide
CID 67562723
4-[(2-methylquinolin-4-yl)methoxy]benzenesulfinic acid
CID 22032785
(2-methylquinolin-4-yl)methanamine;dihydrochloride
CID 42946478
3-[(2-methylquinolin-4-yl)methoxy]benzaldehyde
CID 78994185
3-fluoro-2-[(2-methylquinolin-4-yl)methoxy]aniline
CID 104831438
[4-[(2-methylquinolin-4-yl)methoxy]phenyl] pentanoate
CID 143099066
cis-(1S,2R)-2-methoxycarbonyl-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methyl]cyclopropane-1-carboxylic acid
CID 24800832
tert-butyl 2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methyl]cyclopropane-1-carboxylate
CID 67561637
(1S,2Z)-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methylidene]cyclopropane-1-carboxamide
CID 163750186
4-[[2-(chloromethyl)phenoxy]methyl]-2-methylquinoline
CID 79231433

Frequently Asked Questions

What is the IUPAC name of [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine?
The IUPAC name of [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine (CID 22148915) is [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine.
What is the SMILES notation for [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine?
The canonical SMILES for [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine is Cc1cc(COc2ccc(CN)cc2)c2ccccc2n1.
What is the InChIKey of [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine?
The InChIKey is FAYOYPCEEUBFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-10-15(17-4-2-3-5-18(17)20-13)12-21-16-8-6-14(11-19)7-9-16/h2-10H,11-12,19H2,1H3.
What are the key properties of [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine?
[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine has a molecular weight of 278.36 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-methylquinolin-4-yl)methoxy]phenyl]methanamine is sourced from PubChem (CID 22148915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).