5,7-dichloro-3-ethyl-N-methylquinolin-2-amine

C12H12Cl2N2 — CID 63531730

IUPAC5,7-dichloro-3-ethyl-N-methylquinolin-2-amine
SMILESCCc1cc2c(Cl)cc(Cl)cc2nc1NC
InChIInChI=1S/C12H12Cl2N2/c1-3-7-4-9-10(14)5-8(13)6-11(9)16-12(7)15-2/h4-6H,3H2,1-2H3,(H,15,16)
InChIKeyPMOAFUMCPUVCNP-UHFFFAOYSA-N
MW255.15 g/mol
LogP4.15
Rot. Bonds2

About 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine

5,7-dichloro-3-ethyl-N-methylquinolin-2-amine (PubChem CID 63531730) has the molecular formula C12H12Cl2N2 and a molecular weight of 255.15 g/mol. Its IUPAC name is 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine.

Molecular Properties

Compound Name5,7-dichloro-3-ethyl-N-methylquinolin-2-amine
PubChem CID63531730
Molecular FormulaC12H12Cl2N2
Molecular Weight255.15 g/mol
Exact Mass254.04
IUPAC Name5,7-dichloro-3-ethyl-N-methylquinolin-2-amine
SMILESCCc1cc2c(Cl)cc(Cl)cc2nc1NC
InChIInChI=1S/C12H12Cl2N2/c1-3-7-4-9-10(14)5-8(13)6-11(9)16-12(7)15-2/h4-6H,3H2,1-2H3,(H,15,16)
InChIKeyPMOAFUMCPUVCNP-UHFFFAOYSA-N
XLogP4.15
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.15
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N,5,7-trimethylquinolin-2-amine
CID 63231542
3-ethyl-5,6,7-trifluoro-N-methylquinolin-2-amine
CID 63232484
5-chloro-3-ethyl-8-methoxy-N-methylquinolin-2-amine
CID 63232251
(3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine
CID 63386184
methyl 2-(5,7-dichloroquinolin-2-yl)acetate
CID 82247403
3-ethyl-5,8-difluoro-N,6-dimethylquinolin-2-amine
CID 103587513
1,5-dichloro-3-ethyl-2-methoxybenzene
CID 71215672
(5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine
CID 107370736
5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine
CID 63531557
1,2,5-trichloro-3-ethylbenzene
CID 70861390
3,8-diethyl-N-methylquinolin-2-amine
CID 63232457
3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine
CID 63232558

Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine?
The IUPAC name of 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine (CID 63531730) is 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine.
What is the SMILES notation for 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine?
The canonical SMILES for 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine is CCc1cc2c(Cl)cc(Cl)cc2nc1NC.
What is the InChIKey of 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine?
The InChIKey is PMOAFUMCPUVCNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12Cl2N2/c1-3-7-4-9-10(14)5-8(13)6-11(9)16-12(7)15-2/h4-6H,3H2,1-2H3,(H,15,16).
What are the key properties of 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine?
5,7-dichloro-3-ethyl-N-methylquinolin-2-amine has a molecular weight of 255.15 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-3-ethyl-N-methylquinolin-2-amine is sourced from PubChem (CID 63531730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).