N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine

C15H18N2 — CID 50950146

IUPACN-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine
SMILESCc1cnccc1CN(C)Cc1ccccc1
InChIInChI=1S/C15H18N2/c1-13-10-16-9-8-15(13)12-17(2)11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3
InChIKeyPHIZXTAEGPGEFK-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.02
Rot. Bonds4

About N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine

N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine (PubChem CID 50950146) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine
PubChem CID50950146
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC NameN-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine
SMILESCc1cnccc1CN(C)Cc1ccccc1
InChIInChI=1S/C15H18N2/c1-13-10-16-9-8-15(13)12-17(2)11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3
InChIKeyPHIZXTAEGPGEFK-UHFFFAOYSA-N
XLogP3.02
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-methyl-3-[[methyl-[(3-methyl-4-pyridinyl)methyl]amino]methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 26394218
N-[(2,5-dimethylphenyl)methyl]-N-methyl-1-phenylmethanamine
CID 10610052
4-methyl-7-[[methyl-[(3-methyl-4-pyridinyl)methyl]amino]methyl]chromen-2-one
CID 56718124
3-methyl-4-[2-(4-phenylphenyl)ethyl]pyridine
CID 175565400
N,8-dimethyl-3-[[methyl-[(3-methyl-4-pyridinyl)methyl]amino]methyl]-N-(2-phenylethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42596863
3-methyl-4-[[methyl(pyridin-3-ylmethyl)amino]methyl]benzonitrile
CID 114480999
2-[[methyl(pyridin-4-ylmethyl)amino]methyl]aniline
CID 43458561
3-[[benzyl(methyl)amino]methyl]-4-methylaniline
CID 82129969
N-benzyl-4-(chloromethyl)-N-methylpyridin-3-amine
CID 105067251
(3S)-3-hydroxy-3-[[methyl-[(3-methyl-4-pyridinyl)methyl]amino]methyl]-1-(2-phenylethyl)piperidin-2-one
CID 95211593
N-benzyl-N-methyl-2-pyridin-4-ylethanamine
CID 78793254
N-methyl-2-phenyl-N-(pyridin-4-ylmethyl)ethanamine
CID 3817841

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine?
The IUPAC name of N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine (CID 50950146) is N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine.
What is the SMILES notation for N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine?
The canonical SMILES for N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine is Cc1cnccc1CN(C)Cc1ccccc1.
What is the InChIKey of N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine?
The InChIKey is PHIZXTAEGPGEFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-13-10-16-9-8-15(13)12-17(2)11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3.
What are the key properties of N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine?
N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine has a molecular weight of 226.32 g/mol, XLogP of 3.02, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-1-phenylmethanamine is sourced from PubChem (CID 50950146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).