N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine

C15H18N2O2 — CID 31274915

IUPACN-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine
SMILESCOc1ccc(OC)c2c(C)cc(NC3CC3)nc12
InChIInChI=1S/C15H18N2O2/c1-9-8-13(16-10-4-5-10)17-15-12(19-3)7-6-11(18-2)14(9)15/h6-8,10H,4-5H2,1-3H3,(H,16,17)
InChIKeyVSEMIDZFVKNTEY-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.13
Rot. Bonds4

About N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine

N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine (PubChem CID 31274915) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine
PubChem CID31274915
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine
SMILESCOc1ccc(OC)c2c(C)cc(NC3CC3)nc12
InChIInChI=1S/C15H18N2O2/c1-9-8-13(16-10-4-5-10)17-15-12(19-3)7-6-11(18-2)14(9)15/h6-8,10H,4-5H2,1-3H3,(H,16,17)
InChIKeyVSEMIDZFVKNTEY-UHFFFAOYSA-N
XLogP3.13
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine?
The IUPAC name of N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine (CID 31274915) is N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine.
What is the SMILES notation for N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine?
The canonical SMILES for N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine is COc1ccc(OC)c2c(C)cc(NC3CC3)nc12.
What is the InChIKey of N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine?
The InChIKey is VSEMIDZFVKNTEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-9-8-13(16-10-4-5-10)17-15-12(19-3)7-6-11(18-2)14(9)15/h6-8,10H,4-5H2,1-3H3,(H,16,17).
What are the key properties of N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine?
N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine has a molecular weight of 258.32 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5,8-dimethoxy-4-methylquinolin-2-amine is sourced from PubChem (CID 31274915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).