2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine

C15H14ClN7OS — CID 142788927

IUPAC2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine
SMILESCOc1ccc(-c2nc(Cl)nc(N)c2-c2nc(C)nc(SC)n2)cn1
InChIInChI=1S/C15H14ClN7OS/c1-7-19-13(23-15(20-7)25-3)10-11(21-14(16)22-12(10)17)8-4-5-9(24-2)18-6-8/h4-6H,1-3H3,(H2,17,21,22)
InChIKeySLUWCRZMTCQAKL-UHFFFAOYSA-N
MW375.85 g/mol
LogP2.67
Rot. Bonds4

About 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine

2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine (PubChem CID 142788927) has the molecular formula C15H14ClN7OS and a molecular weight of 375.85 g/mol. Its IUPAC name is 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine
PubChem CID142788927
Molecular FormulaC15H14ClN7OS
Molecular Weight375.85 g/mol
Exact Mass375.07
IUPAC Name2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine
SMILESCOc1ccc(-c2nc(Cl)nc(N)c2-c2nc(C)nc(SC)n2)cn1
InChIInChI=1S/C15H14ClN7OS/c1-7-19-13(23-15(20-7)25-3)10-11(21-14(16)22-12(10)17)8-4-5-9(24-2)18-6-8/h4-6H,1-3H3,(H2,17,21,22)
InChIKeySLUWCRZMTCQAKL-UHFFFAOYSA-N
XLogP2.67
TPSA112.59 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.85
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine with MolForge

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Related Compounds

2-chloro-5-iodo-6-(6-methoxy-3-pyridinyl)pyrimidin-4-amine
CID 142788951
5-bromo-2-chloro-4-(6-methoxy-3-pyridinyl)pyrimidine
CID 134854260
2-chloro-4-(6-methoxy-3-pyridinyl)quinazoline
CID 134202247
5-chloro-4-(6-methoxy-3-pyridinyl)-3-(2-methyl-7H-purin-6-yl)pyridin-2-amine
CID 142788955
3,5-dichloro-4-(6-methoxy-3-pyridinyl)aniline
CID 90390971
5-(6-methoxy-3-pyridinyl)-6-methylpyridin-2-amine
CID 11171929
5-chloro-4-(6-methoxy-3-pyridinyl)-3-[2-methyl-9-(oxan-2-yl)purin-6-yl]pyridin-2-amine
CID 142788989
4-(6-methoxy-3-pyridinyl)-2-methylsulfanyl-6-(trifluoromethyl)pyrimidine
CID 134201944
3-(6-methoxy-3-pyridinyl)-3-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)-2H-pyrazin-2-amine
CID 142788877
N,N-dichloro-4-(6-methoxy-3-pyridinyl)aniline
CID 141410973
5-(4-chlorophenyl)-2-methoxypyridine;ethane
CID 143906878
5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine
CID 79728874

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine?
The IUPAC name of 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine (CID 142788927) is 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine?
The canonical SMILES for 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine is COc1ccc(-c2nc(Cl)nc(N)c2-c2nc(C)nc(SC)n2)cn1.
What is the InChIKey of 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine?
The InChIKey is SLUWCRZMTCQAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN7OS/c1-7-19-13(23-15(20-7)25-3)10-11(21-14(16)22-12(10)17)8-4-5-9(24-2)18-6-8/h4-6H,1-3H3,(H2,17,21,22).
What are the key properties of 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine?
2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine has a molecular weight of 375.85 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(6-methoxy-3-pyridinyl)-5-(4-methyl-6-methylsulfanyl-1,3,5-triazin-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 142788927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).