N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine

C15H16ClN3S — CID 116785082

IUPACN-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCCC1CN=C(Nc2ccc(Cl)c3cccnc23)S1
InChIInChI=1S/C15H16ClN3S/c1-2-4-10-9-18-15(20-10)19-13-7-6-12(16)11-5-3-8-17-14(11)13/h3,5-8,10H,2,4,9H2,1H3,(H,18,19)
InChIKeyGPPJYRINKGJDNF-UHFFFAOYSA-N
MW305.83 g/mol
LogP4.57
Rot. Bonds3

About N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine

N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 116785082) has the molecular formula C15H16ClN3S and a molecular weight of 305.83 g/mol. Its IUPAC name is N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID116785082
Molecular FormulaC15H16ClN3S
Molecular Weight305.83 g/mol
Exact Mass305.08
IUPAC NameN-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCCC1CN=C(Nc2ccc(Cl)c3cccnc23)S1
InChIInChI=1S/C15H16ClN3S/c1-2-4-10-9-18-15(20-10)19-13-7-6-12(16)11-5-3-8-17-14(11)13/h3,5-8,10H,2,4,9H2,1H3,(H,18,19)
InChIKeyGPPJYRINKGJDNF-UHFFFAOYSA-N
XLogP4.57
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.83
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloroquinolin-8-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine
CID 116785087
4-N-(5-chloroquinolin-8-yl)-5-ethylpyrimidine-4,6-diamine
CID 116785833
6-chloro-2-N-(5-chloroquinolin-8-yl)pyridine-2,3-diamine
CID 116783040
5-chloro-N-(2,5-dichloropyrimidin-4-yl)quinolin-8-amine
CID 116785190
5-chloro-N-(3-ethoxy-2,2-dimethylcyclobutyl)quinolin-8-amine
CID 64851147
5-chloro-N-(3-ethylcyclopentyl)quinolin-8-amine
CID 64500044
5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine
CID 116784042
4-[(5-chloroquinolin-8-yl)amino]-2-methylbutan-2-ol
CID 116783853
2-[(5-chloroquinolin-8-yl)amino]pyridine-3-carbonitrile
CID 116784510
3-bromo-4-[(5-propyl-4,5-dihydro-1,3-thiazol-2-yl)amino]benzonitrile
CID 114001990
5-chloro-4-N-(5-chloroquinolin-8-yl)-2-N-methylpyrimidine-2,4-diamine
CID 116785816
1-N-(5-chloroquinolin-8-yl)-4-fluorobenzene-1,2-diamine
CID 116782991

Frequently Asked Questions

What is the IUPAC name of N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine (CID 116785082) is N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine is CCCC1CN=C(Nc2ccc(Cl)c3cccnc23)S1.
What is the InChIKey of N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is GPPJYRINKGJDNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3S/c1-2-4-10-9-18-15(20-10)19-13-7-6-12(16)11-5-3-8-17-14(11)13/h3,5-8,10H,2,4,9H2,1H3,(H,18,19).
What are the key properties of N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine?
N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 305.83 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloroquinolin-8-yl)-5-propyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 116785082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).