7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine

C15H19ClN2 — CID 104722127

IUPAC7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine
SMILESCCNc1nc2cc(Cl)c(C)cc2cc1C(C)C
InChIInChI=1S/C15H19ClN2/c1-5-17-15-12(9(2)3)7-11-6-10(4)13(16)8-14(11)18-15/h6-9H,5H2,1-4H3,(H,17,18)
InChIKeyGNUKCVGLFZBZLI-UHFFFAOYSA-N
MW262.78 g/mol
LogP4.75
Rot. Bonds3

About 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine

7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine (PubChem CID 104722127) has the molecular formula C15H19ClN2 and a molecular weight of 262.78 g/mol. Its IUPAC name is 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine.

Molecular Properties

Compound Name7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine
PubChem CID104722127
Molecular FormulaC15H19ClN2
Molecular Weight262.78 g/mol
Exact Mass262.12
IUPAC Name7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine
SMILESCCNc1nc2cc(Cl)c(C)cc2cc1C(C)C
InChIInChI=1S/C15H19ClN2/c1-5-17-15-12(9(2)3)7-11-6-10(4)13(16)8-14(11)18-15/h6-9H,5H2,1-4H3,(H,17,18)
InChIKeyGNUKCVGLFZBZLI-UHFFFAOYSA-N
XLogP4.75
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.78
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-fluoro-6-methyl-3-propan-2-yl-N-propylquinolin-2-amine
CID 112674490
N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine
CID 63525945
8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine
CID 107629224
7,8-dichloro-N-ethyl-3-propan-2-ylquinolin-2-amine
CID 63524899
8-chloro-N-ethyl-3-propan-2-ylquinolin-2-amine
CID 63525062
N-ethyl-6-methylsulfonyl-3-propan-2-ylquinolin-2-amine
CID 63232227
N-ethyl-6,7,8-trifluoro-3-propan-2-ylquinolin-2-amine
CID 63231864
6-butan-2-yl-N-ethyl-3-methylquinolin-2-amine
CID 55225443
5-chloro-N-ethyl-6-methyl-1,3-benzothiazol-2-amine
CID 82549231
5-chloro-N-ethyl-6,8-dimethoxy-3-propan-2-ylquinolin-2-amine
CID 63525424
5-bromo-N-ethyl-6,8-difluoro-3-propan-2-ylquinolin-2-amine
CID 102855129
6-ethoxy-3-propan-2-yl-N-propylquinolin-2-amine
CID 63529698

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine?
The IUPAC name of 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine (CID 104722127) is 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine.
What is the SMILES notation for 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine?
The canonical SMILES for 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine is CCNc1nc2cc(Cl)c(C)cc2cc1C(C)C.
What is the InChIKey of 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine?
The InChIKey is GNUKCVGLFZBZLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2/c1-5-17-15-12(9(2)3)7-11-6-10(4)13(16)8-14(11)18-15/h6-9H,5H2,1-4H3,(H,17,18).
What are the key properties of 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine?
7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine has a molecular weight of 262.78 g/mol, XLogP of 4.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine is sourced from PubChem (CID 104722127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).