8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine

C15H19ClN2 — CID 107629224

IUPAC8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine
SMILESCCNc1nc2c(Cl)ccc(C)c2cc1C(C)C
InChIInChI=1S/C15H19ClN2/c1-5-17-15-11(9(2)3)8-12-10(4)6-7-13(16)14(12)18-15/h6-9H,5H2,1-4H3,(H,17,18)
InChIKeyZWULKANSIOKIIA-UHFFFAOYSA-N
MW262.78 g/mol
LogP4.75
Rot. Bonds3

About 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine

8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine (PubChem CID 107629224) has the molecular formula C15H19ClN2 and a molecular weight of 262.78 g/mol. Its IUPAC name is 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine.

Molecular Properties

Compound Name8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine
PubChem CID107629224
Molecular FormulaC15H19ClN2
Molecular Weight262.78 g/mol
Exact Mass262.12
IUPAC Name8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine
SMILESCCNc1nc2c(Cl)ccc(C)c2cc1C(C)C
InChIInChI=1S/C15H19ClN2/c1-5-17-15-11(9(2)3)8-12-10(4)6-7-13(16)14(12)18-15/h6-9H,5H2,1-4H3,(H,17,18)
InChIKeyZWULKANSIOKIIA-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

(8-chloro-5-methyl-3-propan-2-ylquinolin-2-yl)hydrazine
CID 107629269
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
8-chloro-5-methyl-3-propan-2-ylquinolin-2-amine
CID 107629220
7-chloro-N-ethyl-6-methyl-3-propan-2-ylquinolin-2-amine
CID 104722127
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
(8-bromo-5-methyl-3-propan-2-ylquinolin-2-yl)hydrazine
CID 82759562
5-bromo-8-chloro-3-methyl-N-propylquinolin-2-amine
CID 63524554
8-chloro-2-propan-2-yl-N-propylquinolin-4-amine
CID 63480780
N-ethyl-6,7,8-trifluoro-3-propan-2-ylquinolin-2-amine
CID 63231864
5,8-dichloro-N,3-diethyl-6-methylquinolin-2-amine
CID 104728368

Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine?
The IUPAC name of 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine (CID 107629224) is 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine.
What is the SMILES notation for 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine?
The canonical SMILES for 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine is CCNc1nc2c(Cl)ccc(C)c2cc1C(C)C.
What is the InChIKey of 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine?
The InChIKey is ZWULKANSIOKIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2/c1-5-17-15-11(9(2)3)8-12-10(4)6-7-13(16)14(12)18-15/h6-9H,5H2,1-4H3,(H,17,18).
What are the key properties of 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine?
8-chloro-N-ethyl-5-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 8-chloro-N-ethyl-5-methyl-3-propan-2-ylquinolin-2-amine is sourced from PubChem (CID 107629224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).