N-methyl-1-(4-quinolin-2-ylphenyl)methanamine

C17H16N2 — CID 116645004

IUPACN-methyl-1-(4-quinolin-2-ylphenyl)methanamine
SMILESCNCc1ccc(-c2ccc3ccccc3n2)cc1
InChIInChI=1S/C17H16N2/c1-18-12-13-6-8-15(9-7-13)17-11-10-14-4-2-3-5-16(14)19-17/h2-11,18H,12H2,1H3
InChIKeyBUEHDFMOEHGOOW-UHFFFAOYSA-N
MW248.33 g/mol
LogP3.62
Rot. Bonds3

About N-methyl-1-(4-quinolin-2-ylphenyl)methanamine

N-methyl-1-(4-quinolin-2-ylphenyl)methanamine (PubChem CID 116645004) has the molecular formula C17H16N2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-methyl-1-(4-quinolin-2-ylphenyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-quinolin-2-ylphenyl)methanamine
PubChem CID116645004
Molecular FormulaC17H16N2
Molecular Weight248.33 g/mol
Exact Mass248.13
IUPAC NameN-methyl-1-(4-quinolin-2-ylphenyl)methanamine
SMILESCNCc1ccc(-c2ccc3ccccc3n2)cc1
InChIInChI=1S/C17H16N2/c1-18-12-13-6-8-15(9-7-13)17-11-10-14-4-2-3-5-16(14)19-17/h2-11,18H,12H2,1H3
InChIKeyBUEHDFMOEHGOOW-UHFFFAOYSA-N
XLogP3.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-propylphenyl)quinoline
CID 69251676
1-(4-quinolin-2-ylphenyl)propan-2-one
CID 82540961
2-(4-hexylphenyl)quinoline;iridium(3+)
CID 161040240
4-(4-quinolin-2-ylphenyl)butan-2-one
CID 82540955
iridium;tris(2-phenylquinoline)
CID 122129463
2-(7-quinolin-2-ylnaphthalen-2-yl)quinoline
CID 176883836
2-[4-(difluoromethyl)phenyl]quinoline
CID 140737123
1-(4-quinolin-2-ylphenyl)ethanone
CID 39226651
N-[(3-quinolin-2-ylphenyl)methyl]propan-2-amine
CID 116645094
dichloroplatinum;2-phenylquinoline
CID 175341425
iridium;bis(2-phenylquinoline);2,2,6,6-tetramethylheptane
CID 157434360
N-methyl-1-[4-(3-methylquinolin-2-yl)oxyphenyl]methanamine
CID 106486733

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-quinolin-2-ylphenyl)methanamine?
The IUPAC name of N-methyl-1-(4-quinolin-2-ylphenyl)methanamine (CID 116645004) is N-methyl-1-(4-quinolin-2-ylphenyl)methanamine.
What is the SMILES notation for N-methyl-1-(4-quinolin-2-ylphenyl)methanamine?
The canonical SMILES for N-methyl-1-(4-quinolin-2-ylphenyl)methanamine is CNCc1ccc(-c2ccc3ccccc3n2)cc1.
What is the InChIKey of N-methyl-1-(4-quinolin-2-ylphenyl)methanamine?
The InChIKey is BUEHDFMOEHGOOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2/c1-18-12-13-6-8-15(9-7-13)17-11-10-14-4-2-3-5-16(14)19-17/h2-11,18H,12H2,1H3.
What are the key properties of N-methyl-1-(4-quinolin-2-ylphenyl)methanamine?
N-methyl-1-(4-quinolin-2-ylphenyl)methanamine has a molecular weight of 248.33 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-quinolin-2-ylphenyl)methanamine is sourced from PubChem (CID 116645004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).