2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine

C15H18F2N2 — CID 55127386

IUPAC2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(C(F)F)nc2c(C)c(C)ccc12
InChIInChI=1S/C15H18F2N2/c1-4-7-18-12-8-13(15(16)17)19-14-10(3)9(2)5-6-11(12)14/h5-6,8,15H,4,7H2,1-3H3,(H,18,19)
InChIKeyPSHJSPKUAQZYKS-UHFFFAOYSA-N
MW264.32 g/mol
LogP4.61
Rot. Bonds4

About 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine

2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine (PubChem CID 55127386) has the molecular formula C15H18F2N2 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine
PubChem CID55127386
Molecular FormulaC15H18F2N2
Molecular Weight264.32 g/mol
Exact Mass264.14
IUPAC Name2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(C(F)F)nc2c(C)c(C)ccc12
InChIInChI=1S/C15H18F2N2/c1-4-7-18-12-8-13(15(16)17)19-14-10(3)9(2)5-6-11(12)14/h5-6,8,15H,4,7H2,1-3H3,(H,18,19)
InChIKeyPSHJSPKUAQZYKS-UHFFFAOYSA-N
XLogP4.61
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-(difluoromethoxy)-2-(difluoromethyl)-N-propylquinolin-4-amine
CID 62892984
2-(difluoromethyl)-8-methoxy-5-methyl-N-propylquinolin-4-amine
CID 62890532
2-(methoxymethyl)-7,8-dimethyl-N-propylquinolin-4-amine
CID 55062350
2-(difluoromethyl)-6-fluoro-8-methoxy-N-propylquinolin-4-amine
CID 62892107
[7-bromo-2-(difluoromethyl)-8-methylquinolin-4-yl]hydrazine
CID 107629088
5-bromo-2-(difluoromethyl)-6,8-difluoro-N-propylquinolin-4-amine
CID 102854988
3-ethyl-2,7,8-trimethyl-N-propylquinolin-4-amine
CID 63480442
8-fluoro-6-methyl-2-propan-2-yl-N-propylquinolin-4-amine
CID 63479615
8-chloro-2-(difluoromethyl)-N-ethylquinolin-4-amine
CID 62890710
5-bromo-2-(difluoromethyl)-N-ethyl-8-methylquinolin-4-amine
CID 62891074
8-chloro-2-propan-2-yl-N-propylquinolin-4-amine
CID 63480780
7,8-difluoro-2-methyl-N-propylquinolin-4-amine
CID 62196946

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine?
The IUPAC name of 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine (CID 55127386) is 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine.
What is the SMILES notation for 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine?
The canonical SMILES for 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine is CCCNc1cc(C(F)F)nc2c(C)c(C)ccc12.
What is the InChIKey of 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine?
The InChIKey is PSHJSPKUAQZYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F2N2/c1-4-7-18-12-8-13(15(16)17)19-14-10(3)9(2)5-6-11(12)14/h5-6,8,15H,4,7H2,1-3H3,(H,18,19).
What are the key properties of 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine?
2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine has a molecular weight of 264.32 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-7,8-dimethyl-N-propylquinolin-4-amine is sourced from PubChem (CID 55127386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).