5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine

C12H14N4 — CID 104533006

IUPAC5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine
SMILESCN(Cc1cccnc1)c1cncc(N)c1
InChIInChI=1S/C12H14N4/c1-16(9-10-3-2-4-14-6-10)12-5-11(13)7-15-8-12/h2-8H,9,13H2,1H3
InChIKeyUCKHKHVESPXGBR-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.70
Rot. Bonds3

About 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine

5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine (PubChem CID 104533006) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine
PubChem CID104533006
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine
SMILESCN(Cc1cccnc1)c1cncc(N)c1
InChIInChI=1S/C12H14N4/c1-16(9-10-3-2-4-14-6-10)12-5-11(13)7-15-8-12/h2-8H,9,13H2,1H3
InChIKeyUCKHKHVESPXGBR-UHFFFAOYSA-N
XLogP1.70
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-2-N-methyl-2-N-(pyridin-3-ylmethyl)pyridine-2,5-diamine
CID 79532611
5-N-methyl-3-N-propyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine
CID 104533005
2-amino-5-[methyl(pyridin-3-ylmethyl)amino]benzonitrile
CID 113323849
5-N-methyl-5-N-(pyridin-3-ylmethyl)-1,2-thiazole-3,5-diamine
CID 103360517
3-(2-aminoethyl)-5-fluoro-N-methyl-N-(pyridin-3-ylmethyl)aniline
CID 106532278
2-N,5-dimethyl-2-N-(pyridin-3-ylmethyl)pyridine-2,3-diamine
CID 66278201
2-amino-N-methyl-4-[methyl(pyridin-3-ylmethyl)amino]benzenesulfonamide
CID 80641227
N,4,6-trimethyl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine
CID 78845350
2-N-methyl-2-N-(pyridin-3-ylmethyl)-1,3-thiazole-2,5-diamine
CID 102767637
4-[methyl(pyridin-3-ylmethyl)amino]benzoic acid
CID 43563540
(1S)-1-[4-[methyl(pyridin-3-ylmethyl)amino]phenyl]ethanol
CID 63371061
CID 174532487
CID 174532487

Frequently Asked Questions

What is the IUPAC name of 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine?
The IUPAC name of 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine (CID 104533006) is 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine.
What is the SMILES notation for 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine?
The canonical SMILES for 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine is CN(Cc1cccnc1)c1cncc(N)c1.
What is the InChIKey of 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine?
The InChIKey is UCKHKHVESPXGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c1-16(9-10-3-2-4-14-6-10)12-5-11(13)7-15-8-12/h2-8H,9,13H2,1H3.
What are the key properties of 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine?
5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine has a molecular weight of 214.27 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine is sourced from PubChem (CID 104533006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).