N-(3,4-dimethylphenyl)pyridin-3-amine

C13H14N2 — CID 82537517

IUPACN-(3,4-dimethylphenyl)pyridin-3-amine
SMILESCc1ccc(Nc2cccnc2)cc1C
InChIInChI=1S/C13H14N2/c1-10-5-6-12(8-11(10)2)15-13-4-3-7-14-9-13/h3-9,15H,1-2H3
InChIKeySRDKSSCDFBMFQY-UHFFFAOYSA-N
MW198.27 g/mol
LogP3.44
Rot. Bonds2

About N-(3,4-dimethylphenyl)pyridin-3-amine

N-(3,4-dimethylphenyl)pyridin-3-amine (PubChem CID 82537517) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)pyridin-3-amine.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)pyridin-3-amine
PubChem CID82537517
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC NameN-(3,4-dimethylphenyl)pyridin-3-amine
SMILESCc1ccc(Nc2cccnc2)cc1C
InChIInChI=1S/C13H14N2/c1-10-5-6-12(8-11(10)2)15-13-4-3-7-14-9-13/h3-9,15H,1-2H3
InChIKeySRDKSSCDFBMFQY-UHFFFAOYSA-N
XLogP3.44
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)pyridin-3-amine?
The IUPAC name of N-(3,4-dimethylphenyl)pyridin-3-amine (CID 82537517) is N-(3,4-dimethylphenyl)pyridin-3-amine.
What is the SMILES notation for N-(3,4-dimethylphenyl)pyridin-3-amine?
The canonical SMILES for N-(3,4-dimethylphenyl)pyridin-3-amine is Cc1ccc(Nc2cccnc2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)pyridin-3-amine?
The InChIKey is SRDKSSCDFBMFQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-10-5-6-12(8-11(10)2)15-13-4-3-7-14-9-13/h3-9,15H,1-2H3.
What are the key properties of N-(3,4-dimethylphenyl)pyridin-3-amine?
N-(3,4-dimethylphenyl)pyridin-3-amine has a molecular weight of 198.27 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)pyridin-3-amine is sourced from PubChem (CID 82537517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).