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

C12H13N3O2 — CID 86771954

IUPACN-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide
SMILESO=C(NC1CCc2nccn2C1)c1ccoc1
InChIInChI=1S/C12H13N3O2/c16-12(9-3-6-17-8-9)14-10-1-2-11-13-4-5-15(11)7-10/h3-6,8,10H,1-2,7H2,(H,14,16)
InChIKeyYTCNVBUNLSOEGC-UHFFFAOYSA-N
MW231.25 g/mol
LogP1.22
Rot. Bonds2

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

N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide (PubChem CID 86771954) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide
PubChem CID86771954
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC NameN-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide
SMILESO=C(NC1CCc2nccn2C1)c1ccoc1
InChIInChI=1S/C12H13N3O2/c16-12(9-3-6-17-8-9)14-10-1-2-11-13-4-5-15(11)7-10/h3-6,8,10H,1-2,7H2,(H,14,16)
InChIKeyYTCNVBUNLSOEGC-UHFFFAOYSA-N
XLogP1.22
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide?
The IUPAC name of N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide (CID 86771954) is N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide.
What is the SMILES notation for N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide?
The canonical SMILES for N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide is O=C(NC1CCc2nccn2C1)c1ccoc1.
What is the InChIKey of N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide?
The InChIKey is YTCNVBUNLSOEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c16-12(9-3-6-17-8-9)14-10-1-2-11-13-4-5-15(11)7-10/h3-6,8,10H,1-2,7H2,(H,14,16).
What are the key properties of N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide?
N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide has a molecular weight of 231.25 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)furan-3-carboxamide is sourced from PubChem (CID 86771954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).