5,6-dibenzylpyridine-2,3,4-triamine

C19H20N4 — CID 19038977

IUPAC5,6-dibenzylpyridine-2,3,4-triamine
SMILESNc1nc(Cc2ccccc2)c(Cc2ccccc2)c(N)c1N
InChIInChI=1S/C19H20N4/c20-17-15(11-13-7-3-1-4-8-13)16(23-19(22)18(17)21)12-14-9-5-2-6-10-14/h1-10H,11-12,21H2,(H4,20,22,23)
InChIKeyXFNDRMNDHDYMNT-UHFFFAOYSA-N
MW304.40 g/mol
LogP3.01
Rot. Bonds4

About 5,6-dibenzylpyridine-2,3,4-triamine

5,6-dibenzylpyridine-2,3,4-triamine (PubChem CID 19038977) has the molecular formula C19H20N4 and a molecular weight of 304.40 g/mol. Its IUPAC name is 5,6-dibenzylpyridine-2,3,4-triamine.

Molecular Properties

Compound Name5,6-dibenzylpyridine-2,3,4-triamine
PubChem CID19038977
Molecular FormulaC19H20N4
Molecular Weight304.40 g/mol
Exact Mass304.17
IUPAC Name5,6-dibenzylpyridine-2,3,4-triamine
SMILESNc1nc(Cc2ccccc2)c(Cc2ccccc2)c(N)c1N
InChIInChI=1S/C19H20N4/c20-17-15(11-13-7-3-1-4-8-13)16(23-19(22)18(17)21)12-14-9-5-2-6-10-14/h1-10H,11-12,21H2,(H4,20,22,23)
InChIKeyXFNDRMNDHDYMNT-UHFFFAOYSA-N
XLogP3.01
TPSA90.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 53.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4,6-dibenzyl-3-nitropyridine-2,5-diamine
CID 164532342
3-benzyl-6-methylbenzene-1,2,4-triamine
CID 88666591
5-benzyl-6-chloropyrimidine-2,4-diamine
CID 45071766
3-benzyl-4,5,6-trifluorobenzene-1,2-diamine
CID 152613756
benzylbenzene;ethane;methanamine
CID 54117827
2-amino-5-benzyl-4-methyl-1H-pyrimidin-6-one
CID 135469356
phenyl(113C)methylbenzene
CID 11194569
5-benzyl-2,3-dimethylimidazol-4-amine
CID 62225752
5-benzylfuran-2-amine
CID 68934924
2-amino-5-(3-anilinopropyl)-4-benzyl-1H-pyrimidin-6-one
CID 135469427
1,4,5-tribenzylimidazol-2-amine
CID 139230439
5-benzyl-4,6-bis(4-fluorophenyl)pyrimidin-2-amine
CID 139449779

Frequently Asked Questions

What is the IUPAC name of 5,6-dibenzylpyridine-2,3,4-triamine?
The IUPAC name of 5,6-dibenzylpyridine-2,3,4-triamine (CID 19038977) is 5,6-dibenzylpyridine-2,3,4-triamine.
What is the SMILES notation for 5,6-dibenzylpyridine-2,3,4-triamine?
The canonical SMILES for 5,6-dibenzylpyridine-2,3,4-triamine is Nc1nc(Cc2ccccc2)c(Cc2ccccc2)c(N)c1N.
What is the InChIKey of 5,6-dibenzylpyridine-2,3,4-triamine?
The InChIKey is XFNDRMNDHDYMNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4/c20-17-15(11-13-7-3-1-4-8-13)16(23-19(22)18(17)21)12-14-9-5-2-6-10-14/h1-10H,11-12,21H2,(H4,20,22,23).
What are the key properties of 5,6-dibenzylpyridine-2,3,4-triamine?
5,6-dibenzylpyridine-2,3,4-triamine has a molecular weight of 304.40 g/mol, XLogP of 3.01, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dibenzylpyridine-2,3,4-triamine is sourced from PubChem (CID 19038977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).