N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine

C18H18N2O — CID 107314976

IUPACN-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine
SMILESCNCc1ccccc1COc1ccc2cccnc2c1
InChIInChI=1S/C18H18N2O/c1-19-12-15-5-2-3-6-16(15)13-21-17-9-8-14-7-4-10-20-18(14)11-17/h2-11,19H,12-13H2,1H3
InChIKeyXHPRUADCBXVJHU-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.53
Rot. Bonds5

About N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine

N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine (PubChem CID 107314976) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine
PubChem CID107314976
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine
SMILESCNCc1ccccc1COc1ccc2cccnc2c1
InChIInChI=1S/C18H18N2O/c1-19-12-15-5-2-3-6-16(15)13-21-17-9-8-14-7-4-10-20-18(14)11-17/h2-11,19H,12-13H2,1H3
InChIKeyXHPRUADCBXVJHU-UHFFFAOYSA-N
XLogP3.53
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[6-(quinolin-7-yloxymethyl)-2-pyridinyl]methanamine
CID 107315161
7-[(2-chlorophenyl)methoxy]quinoline
CID 91807412
N-methyl-1-[2-(pyridin-3-yloxymethyl)phenyl]methanamine
CID 62451935
3-(quinolin-7-yloxymethyl)pyridine-2-carbothioamide
CID 107313737
1-[2-[(3-methoxyphenoxy)methyl]phenyl]-N-methylmethanamine
CID 62453866
N-methyl-2-quinolin-7-yloxypropan-1-amine
CID 107313762
[3-methyl-4-(quinolin-7-yloxymethyl)phenyl]methanamine
CID 107313344
1-[2-[(3-chlorophenoxy)methyl]phenyl]-N-methylmethanamine
CID 62460997
7-phenylmethoxyquinoline;quinolin-7-ol
CID 160975104
5-fluoro-2-(quinolin-7-yloxymethyl)aniline
CID 107313267
N-ethyl-2-quinolin-7-yloxyethanamine
CID 107313475
3-quinolin-7-yloxypropanal
CID 107314214

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine?
The IUPAC name of N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine (CID 107314976) is N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine is CNCc1ccccc1COc1ccc2cccnc2c1.
What is the InChIKey of N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine?
The InChIKey is XHPRUADCBXVJHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-19-12-15-5-2-3-6-16(15)13-21-17-9-8-14-7-4-10-20-18(14)11-17/h2-11,19H,12-13H2,1H3.
What are the key properties of N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine?
N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine has a molecular weight of 278.36 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(quinolin-7-yloxymethyl)phenyl]methanamine is sourced from PubChem (CID 107314976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).