7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine

C18H23BrN2 — CID 107628646

IUPAC7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(C2CCCC2)nc2c(C)c(Br)ccc12
InChIInChI=1S/C18H23BrN2/c1-3-10-20-17-11-16(13-6-4-5-7-13)21-18-12(2)15(19)9-8-14(17)18/h8-9,11,13H,3-7,10H2,1-2H3,(H,20,21)
InChIKeyKDRRALBFZNLSJG-UHFFFAOYSA-N
MW347.30 g/mol
LogP5.79
Rot. Bonds4

About 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine

7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine (PubChem CID 107628646) has the molecular formula C18H23BrN2 and a molecular weight of 347.30 g/mol. Its IUPAC name is 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine
PubChem CID107628646
Molecular FormulaC18H23BrN2
Molecular Weight347.30 g/mol
Exact Mass346.10
IUPAC Name7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(C2CCCC2)nc2c(C)c(Br)ccc12
InChIInChI=1S/C18H23BrN2/c1-3-10-20-17-11-16(13-6-4-5-7-13)21-18-12(2)15(19)9-8-14(17)18/h8-9,11,13H,3-7,10H2,1-2H3,(H,20,21)
InChIKeyKDRRALBFZNLSJG-UHFFFAOYSA-N
XLogP5.79
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.30
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclopropyl-8-methyl-N-propylquinolin-4-amine
CID 63358059
8-chloro-2-cyclopentyl-5-methyl-N-propylquinolin-4-amine
CID 107628758
7-bromo-2-(methoxymethyl)-8-methyl-N-propylquinolin-4-amine
CID 107628600
7-chloro-2-cyclopropyl-8-fluoro-N-propylquinolin-4-amine
CID 63480363
6-bromo-2-cyclopropyl-5,8-difluoro-N-propylquinolin-4-amine
CID 107616783
6-chloro-2-cyclopropyl-8-iodo-N-propylquinolin-4-amine
CID 107628798
7-bromo-2-tert-butyl-N-ethyl-8-methylquinolin-4-amine
CID 107628611
5,8-dibromo-2-cyclopropyl-N-ethylquinolin-4-amine
CID 63484561
(2-cyclopropyl-7,8-dimethylquinolin-4-yl)hydrazine
CID 63358299
7-bromo-6-methyl-N-propyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 107628659
N'-(8-bromo-2-cyclopropylquinolin-4-yl)-N-(5-methyl-2-pyridinyl)ethane-1,2-diamine
CID 166382287
4,7-dichloro-2-cyclopentyl-8-methylquinoline
CID 113390343

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine?
The IUPAC name of 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine (CID 107628646) is 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine.
What is the SMILES notation for 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine?
The canonical SMILES for 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine is CCCNc1cc(C2CCCC2)nc2c(C)c(Br)ccc12.
What is the InChIKey of 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine?
The InChIKey is KDRRALBFZNLSJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23BrN2/c1-3-10-20-17-11-16(13-6-4-5-7-13)21-18-12(2)15(19)9-8-14(17)18/h8-9,11,13H,3-7,10H2,1-2H3,(H,20,21).
What are the key properties of 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine?
7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine has a molecular weight of 347.30 g/mol, XLogP of 5.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-cyclopentyl-8-methyl-N-propylquinolin-4-amine is sourced from PubChem (CID 107628646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).