N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine

C16H21N3 — CID 81246986

IUPACN-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine
SMILESCNCc1cnccc1N(C)Cc1cccc(C)c1
InChIInChI=1S/C16H21N3/c1-13-5-4-6-14(9-13)12-19(3)16-7-8-18-11-15(16)10-17-2/h4-9,11,17H,10,12H2,1-3H3
InChIKeyOWRIGXASPPGXJS-UHFFFAOYSA-N
MW255.37 g/mol
LogP2.75
Rot. Bonds5

About N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine

N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine (PubChem CID 81246986) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine
PubChem CID81246986
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC NameN-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine
SMILESCNCc1cnccc1N(C)Cc1cccc(C)c1
InChIInChI=1S/C16H21N3/c1-13-5-4-6-14(9-13)12-19(3)16-7-8-18-11-15(16)10-17-2/h4-9,11,17H,10,12H2,1-3H3
InChIKeyOWRIGXASPPGXJS-UHFFFAOYSA-N
XLogP2.75
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-chlorophenyl)methyl]-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81246803
N-methyl-N-[(3-methylphenyl)methyl]-3-(propylaminomethyl)pyridin-4-amine
CID 81253106
3-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]pyridin-4-amine
CID 81246098
N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline
CID 61411671
N-(furan-2-ylmethyl)-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81249323
N-[(3-methoxyphenyl)methyl]-N-methyl-2-(methylaminomethyl)aniline
CID 61417843
3-chloro-N-methyl-2-(methylaminomethyl)-N-[(3-methylphenyl)methyl]aniline
CID 61411575
6-N-methyl-6-N-[(3-methylphenyl)methyl]isoquinoline-5,6-diamine
CID 106947745
N-methyl-6-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridazin-3-amine
CID 62289611
N-(furan-3-ylmethyl)-N-methyl-4-(methylaminomethyl)pyridin-3-amine
CID 105073490
N-[(3-chlorophenyl)methyl]-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-3-amine
CID 105073225
N-[(3-fluorophenyl)methyl]-N-methyl-4-(propylaminomethyl)pyridin-3-amine
CID 105072825

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine?
The IUPAC name of N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine (CID 81246986) is N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine.
What is the SMILES notation for N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine?
The canonical SMILES for N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine is CNCc1cnccc1N(C)Cc1cccc(C)c1.
What is the InChIKey of N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine?
The InChIKey is OWRIGXASPPGXJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-13-5-4-6-14(9-13)12-19(3)16-7-8-18-11-15(16)10-17-2/h4-9,11,17H,10,12H2,1-3H3.
What are the key properties of N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine?
N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine has a molecular weight of 255.37 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(methylaminomethyl)-N-[(3-methylphenyl)methyl]pyridin-4-amine is sourced from PubChem (CID 81246986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).