[3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine

C15H19N3 — CID 43248750

IUPAC[3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine
SMILESCN(Cc1cccnc1)Cc1cccc(CN)c1
InChIInChI=1S/C15H19N3/c1-18(12-15-6-3-7-17-10-15)11-14-5-2-4-13(8-14)9-16/h2-8,10H,9,11-12,16H2,1H3
InChIKeyMMLHKNJTEXHYBZ-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.17
Rot. Bonds5

About [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine

[3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine (PubChem CID 43248750) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine.

Molecular Properties

Compound Name[3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine
PubChem CID43248750
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name[3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine
SMILESCN(Cc1cccnc1)Cc1cccc(CN)c1
InChIInChI=1S/C15H19N3/c1-18(12-15-6-3-7-17-10-15)11-14-5-2-4-13(8-14)9-16/h2-8,10H,9,11-12,16H2,1H3
InChIKeyMMLHKNJTEXHYBZ-UHFFFAOYSA-N
XLogP2.17
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[[methyl(pyridin-2-ylmethyl)amino]methyl]phenyl]methanamine
CID 43248751
N'-methyl-N'-(pyridin-3-ylmethyl)butane-1,4-diamine
CID 43563175
3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine
CID 115119904
N'-methyl-N'-(pyridin-3-ylmethyl)but-2-ene-1,4-diamine
CID 77110305
1-(2,3-dihydro-1H-indol-5-yl)-N-methyl-N-(pyridin-3-ylmethyl)methanamine
CID 43563498
N-ethyl-4-[[methyl(pyridin-3-ylmethyl)amino]methyl]pyridin-2-amine
CID 55075650
azane;ethane;3-ethylpyridine;pyridin-3-ylmethanamine
CID 169427277
N-methyl-1-pyridin-3-yl-N-(1,3-thiazol-5-ylmethyl)methanamine
CID 76540758
2-ethyl-1-N-methyl-1-N-(pyridin-3-ylmethyl)butane-1,2-diamine
CID 79813886
1-(4-butylphenyl)-N-methyl-N-(pyridin-3-ylmethyl)methanamine
CID 173272882
[3-(aminomethyl)phenyl]methanamine;azane
CID 175725248
CID 174532487
CID 174532487

Frequently Asked Questions

What is the IUPAC name of [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine?
The IUPAC name of [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine (CID 43248750) is [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine.
What is the SMILES notation for [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine?
The canonical SMILES for [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine is CN(Cc1cccnc1)Cc1cccc(CN)c1.
What is the InChIKey of [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine?
The InChIKey is MMLHKNJTEXHYBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-18(12-15-6-3-7-17-10-15)11-14-5-2-4-13(8-14)9-16/h2-8,10H,9,11-12,16H2,1H3.
What are the key properties of [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine?
[3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine has a molecular weight of 241.34 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine is sourced from PubChem (CID 43248750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).