N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine

C18H25N3 — CID 105348013

IUPACN-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine
SMILESCNCCc1ccc(CN(C)Cc2cccc(C)n2)cc1
InChIInChI=1S/C18H25N3/c1-15-5-4-6-18(20-15)14-21(3)13-17-9-7-16(8-10-17)11-12-19-2/h4-10,19H,11-14H2,1-3H3
InChIKeyYOZFHDMCZCQKMN-UHFFFAOYSA-N
MW283.42 g/mol
LogP2.78
Rot. Bonds7

About N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine

N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine (PubChem CID 105348013) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine
PubChem CID105348013
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine
SMILESCNCCc1ccc(CN(C)Cc2cccc(C)n2)cc1
InChIInChI=1S/C18H25N3/c1-15-5-4-6-18(20-15)14-21(3)13-17-9-7-16(8-10-17)11-12-19-2/h4-10,19H,11-14H2,1-3H3
InChIKeyYOZFHDMCZCQKMN-UHFFFAOYSA-N
XLogP2.78
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine?
The IUPAC name of N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine (CID 105348013) is N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine.
What is the SMILES notation for N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine?
The canonical SMILES for N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine is CNCCc1ccc(CN(C)Cc2cccc(C)n2)cc1.
What is the InChIKey of N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine?
The InChIKey is YOZFHDMCZCQKMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-15-5-4-6-18(20-15)14-21(3)13-17-9-7-16(8-10-17)11-12-19-2/h4-10,19H,11-14H2,1-3H3.
What are the key properties of N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine?
N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine has a molecular weight of 283.42 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-[[methyl-[(6-methyl-2-pyridinyl)methyl]amino]methyl]phenyl]ethanamine is sourced from PubChem (CID 105348013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).