6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine

C16H22N2O2 — CID 62203946

IUPAC6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine
SMILESCCCNc1c(C)c(C)nc2cc(OC)c(OC)cc12
InChIInChI=1S/C16H22N2O2/c1-6-7-17-16-10(2)11(3)18-13-9-15(20-5)14(19-4)8-12(13)16/h8-9H,6-7H2,1-5H3,(H,17,18)
InChIKeyNLMDIDGRQOBCOE-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.69
Rot. Bonds5

About 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine

6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine (PubChem CID 62203946) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine
PubChem CID62203946
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine
SMILESCCCNc1c(C)c(C)nc2cc(OC)c(OC)cc12
InChIInChI=1S/C16H22N2O2/c1-6-7-17-16-10(2)11(3)18-13-9-15(20-5)14(19-4)8-12(13)16/h8-9H,6-7H2,1-5H3,(H,17,18)
InChIKeyNLMDIDGRQOBCOE-UHFFFAOYSA-N
XLogP3.69
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine?
The IUPAC name of 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine (CID 62203946) is 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine.
What is the SMILES notation for 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine?
The canonical SMILES for 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine is CCCNc1c(C)c(C)nc2cc(OC)c(OC)cc12.
What is the InChIKey of 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine?
The InChIKey is NLMDIDGRQOBCOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-6-7-17-16-10(2)11(3)18-13-9-15(20-5)14(19-4)8-12(13)16/h8-9H,6-7H2,1-5H3,(H,17,18).
What are the key properties of 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine?
6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine has a molecular weight of 274.36 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine is sourced from PubChem (CID 62203946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).