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

C15H15N3O3 — CID 53167907

IUPACN-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(Nc1ccc2c(c1)OCO2)c1cn2c(n1)CCCC2
InChIInChI=1S/C15H15N3O3/c19-15(11-8-18-6-2-1-3-14(18)17-11)16-10-4-5-12-13(7-10)21-9-20-12/h4-5,7-8H,1-3,6,9H2,(H,16,19)
InChIKeyNQJDPLPKSLELBA-UHFFFAOYSA-N
MW285.30 g/mol
LogP2.20
Rot. Bonds2

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

N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 53167907) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID53167907
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(Nc1ccc2c(c1)OCO2)c1cn2c(n1)CCCC2
InChIInChI=1S/C15H15N3O3/c19-15(11-8-18-6-2-1-3-14(18)17-11)16-10-4-5-12-13(7-10)21-9-20-12/h4-5,7-8H,1-3,6,9H2,(H,16,19)
InChIKeyNQJDPLPKSLELBA-UHFFFAOYSA-N
XLogP2.20
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide (CID 53167907) is N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide is O=C(Nc1ccc2c(c1)OCO2)c1cn2c(n1)CCCC2.
What is the InChIKey of N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is NQJDPLPKSLELBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c19-15(11-8-18-6-2-1-3-14(18)17-11)16-10-4-5-12-13(7-10)21-9-20-12/h4-5,7-8H,1-3,6,9H2,(H,16,19).
What are the key properties of N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 285.30 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 53167907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).