N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine

C14H16F2N2 — CID 103587507

IUPACN,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine
SMILESCCNc1nc2c(F)cc(C)c(F)c2cc1CC
InChIInChI=1S/C14H16F2N2/c1-4-9-7-10-12(16)8(3)6-11(15)13(10)18-14(9)17-5-2/h6-7H,4-5H2,1-3H3,(H,17,18)
InChIKeyAUBHVVNPKCZKOO-UHFFFAOYSA-N
MW250.29 g/mol
LogP3.82
Rot. Bonds3

About N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine

N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine (PubChem CID 103587507) has the molecular formula C14H16F2N2 and a molecular weight of 250.29 g/mol. Its IUPAC name is N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine.

Molecular Properties

Compound NameN,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine
PubChem CID103587507
Molecular FormulaC14H16F2N2
Molecular Weight250.29 g/mol
Exact Mass250.13
IUPAC NameN,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine
SMILESCCNc1nc2c(F)cc(C)c(F)c2cc1CC
InChIInChI=1S/C14H16F2N2/c1-4-9-7-10-12(16)8(3)6-11(15)13(10)18-14(9)17-5-2/h6-7H,4-5H2,1-3H3,(H,17,18)
InChIKeyAUBHVVNPKCZKOO-UHFFFAOYSA-N
XLogP3.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.29
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-5,8-difluoro-6-methyl-3-propylquinolin-2-amine
CID 103587506
3-ethyl-5,8-difluoro-N,6-dimethylquinolin-2-amine
CID 103587513
N-ethyl-5,6,8-trifluoro-3-propylquinolin-2-amine
CID 55223170
6-chloro-N,3-diethyl-8-fluoroquinolin-2-amine
CID 63530042
5,8-dichloro-N,3-diethyl-6-methylquinolin-2-amine
CID 104728368
N-ethyl-5-fluoro-8-methyl-3-propylquinolin-2-amine
CID 63523830
3-tert-butyl-5,8-difluoro-6-methyl-N-propylquinolin-2-amine
CID 103587511
3-ethyl-5,7,8-trifluoro-N-propylquinolin-2-amine
CID 63523674
(3-ethyl-8-fluoro-5-methylquinolin-2-yl)hydrazine
CID 63232243
(3-ethyl-5-fluoro-8-methylquinolin-2-yl)hydrazine
CID 63232655
3-ethyl-6,8-difluoro-N-propylquinolin-2-amine
CID 63525418
6-chloro-N-ethyl-8-fluoro-3-propylquinolin-2-amine
CID 55224113

Frequently Asked Questions

What is the IUPAC name of N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine?
The IUPAC name of N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine (CID 103587507) is N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine.
What is the SMILES notation for N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine?
The canonical SMILES for N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine is CCNc1nc2c(F)cc(C)c(F)c2cc1CC.
What is the InChIKey of N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine?
The InChIKey is AUBHVVNPKCZKOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F2N2/c1-4-9-7-10-12(16)8(3)6-11(15)13(10)18-14(9)17-5-2/h6-7H,4-5H2,1-3H3,(H,17,18).
What are the key properties of N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine?
N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine has a molecular weight of 250.29 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-diethyl-5,8-difluoro-6-methylquinolin-2-amine is sourced from PubChem (CID 103587507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).