4-(3,4-diethylphenyl)pyridin-2-amine

C15H18N2 — CID 102821959

IUPAC4-(3,4-diethylphenyl)pyridin-2-amine
SMILESCCc1ccc(-c2ccnc(N)c2)cc1CC
InChIInChI=1S/C15H18N2/c1-3-11-5-6-13(9-12(11)4-2)14-7-8-17-15(16)10-14/h5-10H,3-4H2,1-2H3,(H2,16,17)
InChIKeyTWGHDMOPHDJLSB-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.46
Rot. Bonds3

About 4-(3,4-diethylphenyl)pyridin-2-amine

4-(3,4-diethylphenyl)pyridin-2-amine (PubChem CID 102821959) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 4-(3,4-diethylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name4-(3,4-diethylphenyl)pyridin-2-amine
PubChem CID102821959
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name4-(3,4-diethylphenyl)pyridin-2-amine
SMILESCCc1ccc(-c2ccnc(N)c2)cc1CC
InChIInChI=1S/C15H18N2/c1-3-11-5-6-13(9-12(11)4-2)14-7-8-17-15(16)10-14/h5-10H,3-4H2,1-2H3,(H2,16,17)
InChIKeyTWGHDMOPHDJLSB-UHFFFAOYSA-N
XLogP3.46
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3,4-diethylphenyl)pyridin-2-amine?
The IUPAC name of 4-(3,4-diethylphenyl)pyridin-2-amine (CID 102821959) is 4-(3,4-diethylphenyl)pyridin-2-amine.
What is the SMILES notation for 4-(3,4-diethylphenyl)pyridin-2-amine?
The canonical SMILES for 4-(3,4-diethylphenyl)pyridin-2-amine is CCc1ccc(-c2ccnc(N)c2)cc1CC.
What is the InChIKey of 4-(3,4-diethylphenyl)pyridin-2-amine?
The InChIKey is TWGHDMOPHDJLSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-3-11-5-6-13(9-12(11)4-2)14-7-8-17-15(16)10-14/h5-10H,3-4H2,1-2H3,(H2,16,17).
What are the key properties of 4-(3,4-diethylphenyl)pyridin-2-amine?
4-(3,4-diethylphenyl)pyridin-2-amine has a molecular weight of 226.32 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-diethylphenyl)pyridin-2-amine is sourced from PubChem (CID 102821959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).