6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine

C18H17N7S — CID 155339494

IUPAC6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1ccc(-c2cnc3ncnc(NC(C)c4nnc(C)s4)c3c2)nc1
InChIInChI=1S/C18H17N7S/c1-10-4-5-15(19-7-10)13-6-14-16(20-8-13)21-9-22-17(14)23-11(2)18-25-24-12(3)26-18/h4-9,11H,1-3H3,(H,20,21,22,23)
InChIKeyKNQWSKMGTZABNI-UHFFFAOYSA-N
MW363.45 g/mol
LogP3.73
Rot. Bonds4

About 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine

6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 155339494) has the molecular formula C18H17N7S and a molecular weight of 363.45 g/mol. Its IUPAC name is 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine
PubChem CID155339494
Molecular FormulaC18H17N7S
Molecular Weight363.45 g/mol
Exact Mass363.13
IUPAC Name6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1ccc(-c2cnc3ncnc(NC(C)c4nnc(C)s4)c3c2)nc1
InChIInChI=1S/C18H17N7S/c1-10-4-5-15(19-7-10)13-6-14-16(20-8-13)21-9-22-17(14)23-11(2)18-25-24-12(3)26-18/h4-9,11H,1-3H3,(H,20,21,22,23)
InChIKeyKNQWSKMGTZABNI-UHFFFAOYSA-N
XLogP3.73
TPSA89.37 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.45
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine (CID 155339494) is 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine is Cc1ccc(-c2cnc3ncnc(NC(C)c4nnc(C)s4)c3c2)nc1.
What is the InChIKey of 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is KNQWSKMGTZABNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N7S/c1-10-4-5-15(19-7-10)13-6-14-16(20-8-13)21-9-22-17(14)23-11(2)18-25-24-12(3)26-18/h4-9,11H,1-3H3,(H,20,21,22,23).
What are the key properties of 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine?
6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 363.45 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methyl-2-pyridinyl)-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 155339494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).