N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine

C16H20N2O3 — CID 164626575

IUPACN,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine
SMILESCOc1cc(N(C)c2ccnc(C)c2)cc(OC)c1OC
InChIInChI=1S/C16H20N2O3/c1-11-8-12(6-7-17-11)18(2)13-9-14(19-3)16(21-5)15(10-13)20-4/h6-10H,1-5H3
InChIKeyUQJRQDFLZFGXKQ-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.18
Rot. Bonds5

About N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine

N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine (PubChem CID 164626575) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine
PubChem CID164626575
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC NameN,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine
SMILESCOc1cc(N(C)c2ccnc(C)c2)cc(OC)c1OC
InChIInChI=1S/C16H20N2O3/c1-11-8-12(6-7-17-11)18(2)13-9-14(19-3)16(21-5)15(10-13)20-4/h6-10H,1-5H3
InChIKeyUQJRQDFLZFGXKQ-UHFFFAOYSA-N
XLogP3.18
TPSA43.82 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine?
The IUPAC name of N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine (CID 164626575) is N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine.
What is the SMILES notation for N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine?
The canonical SMILES for N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine is COc1cc(N(C)c2ccnc(C)c2)cc(OC)c1OC.
What is the InChIKey of N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine?
The InChIKey is UQJRQDFLZFGXKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-11-8-12(6-7-17-11)18(2)13-9-14(19-3)16(21-5)15(10-13)20-4/h6-10H,1-5H3.
What are the key properties of N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine?
N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine has a molecular weight of 288.35 g/mol, XLogP of 3.18, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(3,4,5-trimethoxyphenyl)pyridin-4-amine is sourced from PubChem (CID 164626575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).