N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine

C16H20N2 — CID 102824735

IUPACN-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine
SMILESCCNc1ccnc(-c2ccc(C(C)C)cc2)c1
InChIInChI=1S/C16H20N2/c1-4-17-15-9-10-18-16(11-15)14-7-5-13(6-8-14)12(2)3/h5-12H,4H2,1-3H3,(H,17,18)
InChIKeyTXIZEPJMQUCEFZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.30
Rot. Bonds4

About N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine

N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine (PubChem CID 102824735) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine
PubChem CID102824735
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine
SMILESCCNc1ccnc(-c2ccc(C(C)C)cc2)c1
InChIInChI=1S/C16H20N2/c1-4-17-15-9-10-18-16(11-15)14-7-5-13(6-8-14)12(2)3/h5-12H,4H2,1-3H3,(H,17,18)
InChIKeyTXIZEPJMQUCEFZ-UHFFFAOYSA-N
XLogP4.30
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine?
The IUPAC name of N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine (CID 102824735) is N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine.
What is the SMILES notation for N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine?
The canonical SMILES for N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine is CCNc1ccnc(-c2ccc(C(C)C)cc2)c1.
What is the InChIKey of N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine?
The InChIKey is TXIZEPJMQUCEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-4-17-15-9-10-18-16(11-15)14-7-5-13(6-8-14)12(2)3/h5-12H,4H2,1-3H3,(H,17,18).
What are the key properties of N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine?
N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine has a molecular weight of 240.35 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-propan-2-ylphenyl)pyridin-4-amine is sourced from PubChem (CID 102824735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).