7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one

C16H17N5O2S — CID 164921764

IUPAC7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESCc1ncc(C(=O)N2CCC(c3ccnc4[nH]c(=O)[nH]c34)CC2)s1
InChIInChI=1S/C16H17N5O2S/c1-9-18-8-12(24-9)15(22)21-6-3-10(4-7-21)11-2-5-17-14-13(11)19-16(23)20-14/h2,5,8,10H,3-4,6-7H2,1H3,(H2,17,19,20,23)
InChIKeyFPFSNVITPBPOEJ-UHFFFAOYSA-N
MW343.41 g/mol
LogP2.04
Rot. Bonds2

About 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one

7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one (PubChem CID 164921764) has the molecular formula C16H17N5O2S and a molecular weight of 343.41 g/mol. Its IUPAC name is 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
PubChem CID164921764
Molecular FormulaC16H17N5O2S
Molecular Weight343.41 g/mol
Exact Mass343.11
IUPAC Name7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESCc1ncc(C(=O)N2CCC(c3ccnc4[nH]c(=O)[nH]c34)CC2)s1
InChIInChI=1S/C16H17N5O2S/c1-9-18-8-12(24-9)15(22)21-6-3-10(4-7-21)11-2-5-17-14-13(11)19-16(23)20-14/h2,5,8,10H,3-4,6-7H2,1H3,(H2,17,19,20,23)
InChIKeyFPFSNVITPBPOEJ-UHFFFAOYSA-N
XLogP2.04
TPSA94.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.41
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one (CID 164921764) is 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one is Cc1ncc(C(=O)N2CCC(c3ccnc4[nH]c(=O)[nH]c34)CC2)s1.
What is the InChIKey of 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The InChIKey is FPFSNVITPBPOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O2S/c1-9-18-8-12(24-9)15(22)21-6-3-10(4-7-21)11-2-5-17-14-13(11)19-16(23)20-14/h2,5,8,10H,3-4,6-7H2,1H3,(H2,17,19,20,23).
What are the key properties of 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one has a molecular weight of 343.41 g/mol, XLogP of 2.04, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(2-methyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 164921764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).