2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine

C14H14F2N2O — CID 55188923

IUPAC2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine
SMILESCNc1cc(C2CC2)nc2c(OC(F)F)cccc12
InChIInChI=1S/C14H14F2N2O/c1-17-11-7-10(8-5-6-8)18-13-9(11)3-2-4-12(13)19-14(15)16/h2-4,7-8,14H,5-6H2,1H3,(H,17,18)
InChIKeyJYKIPEQXKGQYBJ-UHFFFAOYSA-N
MW264.27 g/mol
LogP3.76
Rot. Bonds4

About 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine

2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine (PubChem CID 55188923) has the molecular formula C14H14F2N2O and a molecular weight of 264.27 g/mol. Its IUPAC name is 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine
PubChem CID55188923
Molecular FormulaC14H14F2N2O
Molecular Weight264.27 g/mol
Exact Mass264.11
IUPAC Name2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine
SMILESCNc1cc(C2CC2)nc2c(OC(F)F)cccc12
InChIInChI=1S/C14H14F2N2O/c1-17-11-7-10(8-5-6-8)18-13-9(11)3-2-4-12(13)19-14(15)16/h2-4,7-8,14H,5-6H2,1H3,(H,17,18)
InChIKeyJYKIPEQXKGQYBJ-UHFFFAOYSA-N
XLogP3.76
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-8-methoxy-N-methylquinolin-4-amine
CID 63357697
8-chloro-2-cyclopropyl-N-methylquinolin-4-amine
CID 63358201
6-chloro-2-cyclopropyl-8-fluoro-N-methylquinolin-4-amine
CID 63357835
8-(difluoromethoxy)-2-methyl-N-propylquinolin-4-amine
CID 62198376
2-cyclopropyl-N-ethyl-8-fluoroquinolin-4-amine
CID 55190878
8-(difluoromethoxy)-2-(difluoromethyl)-N-propylquinolin-4-amine
CID 62892984
8-(difluoromethoxy)-3-ethyl-N,2-dimethylquinolin-4-amine
CID 62195939
8-bromo-2-cyclopropyl-N,6-dimethylquinolin-4-amine
CID 63357923
2-cyclopropyl-8-methyl-N-propylquinolin-4-amine
CID 63358059
2-cyclopropyl-8-(trifluoromethoxy)quinolin-4-amine
CID 55190335
2-cyclopropyl-N,6-dimethylquinolin-4-amine
CID 63358146
5-bromo-2-cyclopropyl-8-methoxy-N-methylquinolin-4-amine
CID 63357753

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine?
The IUPAC name of 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine (CID 55188923) is 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine.
What is the SMILES notation for 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine?
The canonical SMILES for 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine is CNc1cc(C2CC2)nc2c(OC(F)F)cccc12.
What is the InChIKey of 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine?
The InChIKey is JYKIPEQXKGQYBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c1-17-11-7-10(8-5-6-8)18-13-9(11)3-2-4-12(13)19-14(15)16/h2-4,7-8,14H,5-6H2,1H3,(H,17,18).
What are the key properties of 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine?
2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine has a molecular weight of 264.27 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-8-(difluoromethoxy)-N-methylquinolin-4-amine is sourced from PubChem (CID 55188923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).