N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine

C16H19NO — CID 19744687

IUPACN-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine
SMILESCNCc1cccc(OCc2ccccc2C)c1
InChIInChI=1S/C16H19NO/c1-13-6-3-4-8-15(13)12-18-16-9-5-7-14(10-16)11-17-2/h3-10,17H,11-12H2,1-2H3
InChIKeyIBPQSYFSIRSODR-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.29
Rot. Bonds5

About N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine

N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine (PubChem CID 19744687) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine
PubChem CID19744687
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine
SMILESCNCc1cccc(OCc2ccccc2C)c1
InChIInChI=1S/C16H19NO/c1-13-6-3-4-8-15(13)12-18-16-9-5-7-14(10-16)11-17-2/h3-10,17H,11-12H2,1-2H3
InChIKeyIBPQSYFSIRSODR-UHFFFAOYSA-N
XLogP3.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]propan-2-amine
CID 39368949
N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]propan-1-amine
CID 39368953
1-[3-[(2-chlorophenyl)methoxy]phenyl]-N-methylmethanamine;hydrochloride
CID 17290694
1-[3-[(2,3-difluorophenyl)methoxy]phenyl]-N-methylmethanamine
CID 43658767
1-[3,5-dimethyl-4-[(2-methylphenyl)methoxy]phenyl]-N-methylmethanamine
CID 43276668
(2S)-2-[[3-[(2-methylphenyl)methoxy]phenyl]methylamino]butan-1-ol
CID 51993135
1-methyl-2-[(3-methylphenoxy)methyl]benzene
CID 60627935
N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine
CID 106486033
N-methyl-1-[3-[(3-methylphenoxy)methyl]phenyl]methanamine
CID 55077028
1-[3-(furan-3-ylmethoxy)phenyl]-N-methylmethanamine
CID 106486019
1-[3,5-difluoro-4-[(2-methylphenyl)methoxy]phenyl]-N-methylmethanamine
CID 79891486
4-methyl-2-[[3-[(2-methylphenyl)methoxy]phenyl]methylamino]pentanoic acid
CID 66528160

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine?
The IUPAC name of N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine (CID 19744687) is N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine?
The canonical SMILES for N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine is CNCc1cccc(OCc2ccccc2C)c1.
What is the InChIKey of N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine?
The InChIKey is IBPQSYFSIRSODR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-13-6-3-4-8-15(13)12-18-16-9-5-7-14(10-16)11-17-2/h3-10,17H,11-12H2,1-2H3.
What are the key properties of N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine?
N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine has a molecular weight of 241.33 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine is sourced from PubChem (CID 19744687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).