2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine

C16H11ClN4S — CID 82065968

IUPAC2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(Nc3cccc4cccnc34)nc(Cl)nc2s1
InChIInChI=1S/C16H11ClN4S/c1-9-8-11-14(20-16(17)21-15(11)22-9)19-12-6-2-4-10-5-3-7-18-13(10)12/h2-8H,1H3,(H,19,20,21)
InChIKeyOMLWVRGSPCYFAR-UHFFFAOYSA-N
MW326.81 g/mol
LogP4.94
Rot. Bonds2

About 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine

2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 82065968) has the molecular formula C16H11ClN4S and a molecular weight of 326.81 g/mol. Its IUPAC name is 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine
PubChem CID82065968
Molecular FormulaC16H11ClN4S
Molecular Weight326.81 g/mol
Exact Mass326.04
IUPAC Name2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(Nc3cccc4cccnc34)nc(Cl)nc2s1
InChIInChI=1S/C16H11ClN4S/c1-9-8-11-14(20-16(17)21-15(11)22-9)19-12-6-2-4-10-5-3-7-18-13(10)12/h2-8H,1H3,(H,19,20,21)
InChIKeyOMLWVRGSPCYFAR-UHFFFAOYSA-N
XLogP4.94
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.81
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-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-chloro-6-methyl-N-naphthalen-1-ylthieno[2,3-d]pyrimidin-4-amine
CID 82066002
5-[(2-chloro-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]naphthalen-1-ol
CID 82065977
2-chloro-6-methyl-N-(2,3,4-trifluorophenyl)thieno[2,3-d]pyrimidin-4-amine
CID 103320354
N-(5-bromo-2-methylphenyl)-2-chloro-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 103320740
2-chloro-N-(3,4-dichlorophenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 82065955
N-(3,6-dichloro-1,2,4-triazin-5-yl)quinolin-8-amine
CID 81035858
2-chloro-6-methyl-N-(3-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 103320341
2-chloro-6-methyl-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 82066295
3-chloro-4-[(2-chloro-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]benzonitrile
CID 107809560
3-methyl-2-N-quinolin-8-ylpyridine-2,5-diamine
CID 62476690
2-chloro-6-methyl-N-(2-pyridin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine
CID 103320757
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]quinolin-8-amine
CID 43103063

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine (CID 82065968) is 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine is Cc1cc2c(Nc3cccc4cccnc34)nc(Cl)nc2s1.
What is the InChIKey of 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is OMLWVRGSPCYFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN4S/c1-9-8-11-14(20-16(17)21-15(11)22-9)19-12-6-2-4-10-5-3-7-18-13(10)12/h2-8H,1H3,(H,19,20,21).
What are the key properties of 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine?
2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 326.81 g/mol, XLogP of 4.94, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methyl-N-quinolin-8-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 82065968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).