N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide

C16H17N5O2S — CID 86772539

IUPACN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
SMILESCc1cn2c(n1)CCC(NC(=O)Cn1cnc3sccc3c1=O)C2
InChIInChI=1S/C16H17N5O2S/c1-10-6-20-7-11(2-3-13(20)18-10)19-14(22)8-21-9-17-15-12(16(21)23)4-5-24-15/h4-6,9,11H,2-3,7-8H2,1H3,(H,19,22)
InChIKeyVKQCVIPQZIDTTF-UHFFFAOYSA-N
MW343.41 g/mol
LogP1.09
Rot. Bonds3

About N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide

N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide (PubChem CID 86772539) has the molecular formula C16H17N5O2S and a molecular weight of 343.41 g/mol. Its IUPAC name is N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
PubChem CID86772539
Molecular FormulaC16H17N5O2S
Molecular Weight343.41 g/mol
Exact Mass343.11
IUPAC NameN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
SMILESCc1cn2c(n1)CCC(NC(=O)Cn1cnc3sccc3c1=O)C2
InChIInChI=1S/C16H17N5O2S/c1-10-6-20-7-11(2-3-13(20)18-10)19-14(22)8-21-9-17-15-12(16(21)23)4-5-24-15/h4-6,9,11H,2-3,7-8H2,1H3,(H,19,22)
InChIKeyVKQCVIPQZIDTTF-UHFFFAOYSA-N
XLogP1.09
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.41
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide
CID 86772662
N-[(1R,2R)-2-hydroxycyclohexyl]-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 104927943
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95766083
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-thiophen-2-ylacetamide
CID 86772548
2-(2,4-dioxo-1,3-diazinan-1-yl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 96502955
2-(1-methylindol-3-yl)-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
CID 86772729
N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-(2-oxo-1,3-diazinan-1-yl)acetamide
CID 95766034
N-(5-methyl-1,3-thiazol-2-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 26197720
2-(2-ethyl-1,3-thiazol-4-yl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95765998
N-(4-hydroxy-6-methyl-2-oxopyran-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 155969947
2-(3-methylphenyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95788774
N-(methylcarbamoyl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 8594302

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide?
The IUPAC name of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide (CID 86772539) is N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide.
What is the SMILES notation for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide?
The canonical SMILES for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide is Cc1cn2c(n1)CCC(NC(=O)Cn1cnc3sccc3c1=O)C2.
What is the InChIKey of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide?
The InChIKey is VKQCVIPQZIDTTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O2S/c1-10-6-20-7-11(2-3-13(20)18-10)19-14(22)8-21-9-17-15-12(16(21)23)4-5-24-15/h4-6,9,11H,2-3,7-8H2,1H3,(H,19,22).
What are the key properties of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide?
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide has a molecular weight of 343.41 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide is sourced from PubChem (CID 86772539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).