2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine

C20H31N3 — CID 176699723

IUPAC2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine
SMILESCCc1ccnc(CN(C)C)c1.Cc1cc(C(C)C)cc(C)n1
InChIInChI=1S/C10H16N2.C10H15N/c1-4-9-5-6-11-10(7-9)8-12(2)3;1-7(2)10-5-8(3)11-9(4)6-10/h5-7H,4,8H2,1-3H3;5-7H,1-4H3
InChIKeyFXGRNQABXHTJQY-UHFFFAOYSA-N
MW313.49 g/mol
LogP4.53
Rot. Bonds4

About 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine

2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine (PubChem CID 176699723) has the molecular formula C20H31N3 and a molecular weight of 313.49 g/mol. Its IUPAC name is 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine
PubChem CID176699723
Molecular FormulaC20H31N3
Molecular Weight313.49 g/mol
Exact Mass313.25
IUPAC Name2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine
SMILESCCc1ccnc(CN(C)C)c1.Cc1cc(C(C)C)cc(C)n1
InChIInChI=1S/C10H16N2.C10H15N/c1-4-9-5-6-11-10(7-9)8-12(2)3;1-7(2)10-5-8(3)11-9(4)6-10/h5-7H,4,8H2,1-3H3;5-7H,1-4H3
InChIKeyFXGRNQABXHTJQY-UHFFFAOYSA-N
XLogP4.53
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.49
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine?
The IUPAC name of 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine (CID 176699723) is 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine.
What is the SMILES notation for 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine?
The canonical SMILES for 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine is CCc1ccnc(CN(C)C)c1.Cc1cc(C(C)C)cc(C)n1.
What is the InChIKey of 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine?
The InChIKey is FXGRNQABXHTJQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2.C10H15N/c1-4-9-5-6-11-10(7-9)8-12(2)3;1-7(2)10-5-8(3)11-9(4)6-10/h5-7H,4,8H2,1-3H3;5-7H,1-4H3.
What are the key properties of 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine?
2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine has a molecular weight of 313.49 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-propan-2-ylpyridine;1-(4-ethyl-2-pyridinyl)-N,N-dimethylmethanamine is sourced from PubChem (CID 176699723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).