5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide

C16H21N3O2 — CID 129328694

IUPAC5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide
SMILESCCc1cc(C)c(C(=O)NC[C@H]2CCc3nccn3C2)o1
InChIInChI=1S/C16H21N3O2/c1-3-13-8-11(2)15(21-13)16(20)18-9-12-4-5-14-17-6-7-19(14)10-12/h6-8,12H,3-5,9-10H2,1-2H3,(H,18,20)/t12-/m1/s1
InChIKeyCCAHZEFSWYXDFL-GFCCVEGCSA-N
MW287.36 g/mol
LogP2.34
Rot. Bonds4

About 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide

5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide (PubChem CID 129328694) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide
PubChem CID129328694
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide
SMILESCCc1cc(C)c(C(=O)NC[C@H]2CCc3nccn3C2)o1
InChIInChI=1S/C16H21N3O2/c1-3-13-8-11(2)15(21-13)16(20)18-9-12-4-5-14-17-6-7-19(14)10-12/h6-8,12H,3-5,9-10H2,1-2H3,(H,18,20)/t12-/m1/s1
InChIKeyCCAHZEFSWYXDFL-GFCCVEGCSA-N
XLogP2.34
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide?
The IUPAC name of 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide (CID 129328694) is 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide?
The canonical SMILES for 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide is CCc1cc(C)c(C(=O)NC[C@H]2CCc3nccn3C2)o1.
What is the InChIKey of 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide?
The InChIKey is CCAHZEFSWYXDFL-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-3-13-8-11(2)15(21-13)16(20)18-9-12-4-5-14-17-6-7-19(14)10-12/h6-8,12H,3-5,9-10H2,1-2H3,(H,18,20)/t12-/m1/s1.
What are the key properties of 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide?
5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide is sourced from PubChem (CID 129328694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).