N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide

C17H15N3O2S — CID 56675560

IUPACN-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide
SMILESCc1oc(-c2cccnc2)cc1C(=O)Nc1nc2c(s1)CCC2
InChIInChI=1S/C17H15N3O2S/c1-10-12(8-14(22-10)11-4-3-7-18-9-11)16(21)20-17-19-13-5-2-6-15(13)23-17/h3-4,7-9H,2,5-6H2,1H3,(H,19,20,21)
InChIKeyPACITIMNPZYPTE-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.85
Rot. Bonds3

About N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide

N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide (PubChem CID 56675560) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide
PubChem CID56675560
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC NameN-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide
SMILESCc1oc(-c2cccnc2)cc1C(=O)Nc1nc2c(s1)CCC2
InChIInChI=1S/C17H15N3O2S/c1-10-12(8-14(22-10)11-4-3-7-18-9-11)16(21)20-17-19-13-5-2-6-15(13)23-17/h3-4,7-9H,2,5-6H2,1H3,(H,19,20,21)
InChIKeyPACITIMNPZYPTE-UHFFFAOYSA-N
XLogP3.85
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide?
The IUPAC name of N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide (CID 56675560) is N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide.
What is the SMILES notation for N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide?
The canonical SMILES for N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide is Cc1oc(-c2cccnc2)cc1C(=O)Nc1nc2c(s1)CCC2.
What is the InChIKey of N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide?
The InChIKey is PACITIMNPZYPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c1-10-12(8-14(22-10)11-4-3-7-18-9-11)16(21)20-17-19-13-5-2-6-15(13)23-17/h3-4,7-9H,2,5-6H2,1H3,(H,19,20,21).
What are the key properties of N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide?
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide has a molecular weight of 325.39 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-5-pyridin-3-ylfuran-3-carboxamide is sourced from PubChem (CID 56675560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).