3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine

C13H15N3 — CID 82537509

IUPAC3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine
SMILESCN(C)c1cccc(Nc2cccnc2)c1
InChIInChI=1S/C13H15N3/c1-16(2)13-7-3-5-11(9-13)15-12-6-4-8-14-10-12/h3-10,15H,1-2H3
InChIKeyCXZPJVGGHQKYED-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.89
Rot. Bonds3

About 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine

3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine (PubChem CID 82537509) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine
PubChem CID82537509
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine
SMILESCN(C)c1cccc(Nc2cccnc2)c1
InChIInChI=1S/C13H15N3/c1-16(2)13-7-3-5-11(9-13)15-12-6-4-8-14-10-12/h3-10,15H,1-2H3
InChIKeyCXZPJVGGHQKYED-UHFFFAOYSA-N
XLogP2.89
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-[3-(dimethylamino)phenyl]pyridine-2,5-diamine
CID 113297468
3-[3-(dimethylamino)phenyl]-5-N-pyridin-3-ylbenzimidazole-2,5-diamine
CID 90682918
3-(dimethylamino)-N-pyridin-3-ylbenzamide
CID 23793187
3-N-[3-(dimethylamino)phenyl]benzene-1,3-diamine
CID 115376107
N,N-dimethylpyridin-3-amine;hydrochloride
CID 23028557
N-(3,4-dimethylphenyl)pyridin-3-amine
CID 82537517
2-N-[3-(dimethylamino)phenyl]pyridine-2,3-diamine
CID 115376029
3-N,3-N-dimethyl-1-N-(4-pyridin-4-ylpyrimidin-2-yl)benzene-1,3-diamine
CID 14347136
1-N-(5-bromo-2-pyridinyl)-3-N,3-N-dimethylbenzene-1,3-diamine
CID 115379125
3-N,3-N-dimethyl-1-N-pyrido[2,3-d]pyrimidin-4-ylbenzene-1,3-diamine
CID 110435229
[3-(dimethylamino)phenyl]-pyridin-3-ylmethanone
CID 105081243
azane;N-methylpyridin-3-amine
CID 70247108

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine?
The IUPAC name of 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine (CID 82537509) is 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine is CN(C)c1cccc(Nc2cccnc2)c1.
What is the InChIKey of 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine?
The InChIKey is CXZPJVGGHQKYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-16(2)13-7-3-5-11(9-13)15-12-6-4-8-14-10-12/h3-10,15H,1-2H3.
What are the key properties of 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine?
3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine has a molecular weight of 213.28 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-1-N-pyridin-3-ylbenzene-1,3-diamine is sourced from PubChem (CID 82537509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).