8-methoxy-5-methyl-N-propylquinolin-4-amine

C14H18N2O — CID 55045426

IUPAC8-methoxy-5-methyl-N-propylquinolin-4-amine
SMILESCCCNc1ccnc2c(OC)ccc(C)c12
InChIInChI=1S/C14H18N2O/c1-4-8-15-11-7-9-16-14-12(17-3)6-5-10(2)13(11)14/h5-7,9H,4,8H2,1-3H3,(H,15,16)
InChIKeyQXVIJKCATKRFIL-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.37
Rot. Bonds4

About 8-methoxy-5-methyl-N-propylquinolin-4-amine

8-methoxy-5-methyl-N-propylquinolin-4-amine (PubChem CID 55045426) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 8-methoxy-5-methyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name8-methoxy-5-methyl-N-propylquinolin-4-amine
PubChem CID55045426
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name8-methoxy-5-methyl-N-propylquinolin-4-amine
SMILESCCCNc1ccnc2c(OC)ccc(C)c12
InChIInChI=1S/C14H18N2O/c1-4-8-15-11-7-9-16-14-12(17-3)6-5-10(2)13(11)14/h5-7,9H,4,8H2,1-3H3,(H,15,16)
InChIKeyQXVIJKCATKRFIL-UHFFFAOYSA-N
XLogP3.37
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-5-methyl-N-propylquinolin-4-amine?
The IUPAC name of 8-methoxy-5-methyl-N-propylquinolin-4-amine (CID 55045426) is 8-methoxy-5-methyl-N-propylquinolin-4-amine.
What is the SMILES notation for 8-methoxy-5-methyl-N-propylquinolin-4-amine?
The canonical SMILES for 8-methoxy-5-methyl-N-propylquinolin-4-amine is CCCNc1ccnc2c(OC)ccc(C)c12.
What is the InChIKey of 8-methoxy-5-methyl-N-propylquinolin-4-amine?
The InChIKey is QXVIJKCATKRFIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-4-8-15-11-7-9-16-14-12(17-3)6-5-10(2)13(11)14/h5-7,9H,4,8H2,1-3H3,(H,15,16).
What are the key properties of 8-methoxy-5-methyl-N-propylquinolin-4-amine?
8-methoxy-5-methyl-N-propylquinolin-4-amine has a molecular weight of 230.31 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-5-methyl-N-propylquinolin-4-amine is sourced from PubChem (CID 55045426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).