8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine

C12H12ClIN2 — CID 107607884

IUPAC8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine
SMILESCCNc1cc(C)nc2c(Cl)cc(I)cc12
InChIInChI=1S/C12H12ClIN2/c1-3-15-11-4-7(2)16-12-9(11)5-8(14)6-10(12)13/h4-6H,3H2,1-2H3,(H,15,16)
InChIKeyCWDGQNPWXWWDLL-UHFFFAOYSA-N
MW346.60 g/mol
LogP4.23
Rot. Bonds2

About 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine

8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine (PubChem CID 107607884) has the molecular formula C12H12ClIN2 and a molecular weight of 346.60 g/mol. Its IUPAC name is 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine.

Molecular Properties

Compound Name8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine
PubChem CID107607884
Molecular FormulaC12H12ClIN2
Molecular Weight346.60 g/mol
Exact Mass345.97
IUPAC Name8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine
SMILESCCNc1cc(C)nc2c(Cl)cc(I)cc12
InChIInChI=1S/C12H12ClIN2/c1-3-15-11-4-7(2)16-12-9(11)5-8(14)6-10(12)13/h4-6H,3H2,1-2H3,(H,15,16)
InChIKeyCWDGQNPWXWWDLL-UHFFFAOYSA-N
XLogP4.23
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.60
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(8-chloro-6-iodo-2-propylquinolin-4-yl)hydrazine
CID 107607953
4,8-dichloro-3-ethyl-6-iodo-2-methylquinoline
CID 107607583
8-chloro-N-ethyl-6-methyl-2-propylquinolin-4-amine
CID 63479378
6-bromo-8-chloro-N-ethyl-2-(trifluoromethyl)quinolin-4-amine
CID 63479069
8-chloro-N,2-diethyl-6-fluoroquinolin-4-amine
CID 63479104
4-N-[(3-chloro-4-methylphenyl)methyl]-8-N-ethyl-2-methylquinoline-4,8-diamine
CID 70849512
8-chloro-6-iodo-2-propylquinolin-4-amine
CID 107607915
8-chloro-N-ethyl-6-fluoro-2-(methoxymethyl)quinolin-4-amine
CID 62320077
N-ethyl-2,6-dimethylquinolin-4-amine
CID 62201642
8-chloro-6-methyl-N,2-dipropylquinolin-4-amine
CID 63479380
7-chloro-N-ethyl-8-methyl-2-(trifluoromethyl)quinolin-4-amine
CID 55197100
6-chloro-N-ethyl-8-methyl-2-propylquinolin-4-amine
CID 63480980

Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine?
The IUPAC name of 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine (CID 107607884) is 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine.
What is the SMILES notation for 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine?
The canonical SMILES for 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine is CCNc1cc(C)nc2c(Cl)cc(I)cc12.
What is the InChIKey of 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine?
The InChIKey is CWDGQNPWXWWDLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClIN2/c1-3-15-11-4-7(2)16-12-9(11)5-8(14)6-10(12)13/h4-6H,3H2,1-2H3,(H,15,16).
What are the key properties of 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine?
8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine has a molecular weight of 346.60 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-ethyl-6-iodo-2-methylquinolin-4-amine is sourced from PubChem (CID 107607884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).