N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

C20H24N4O2 — CID 138995782

IUPACN-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(N2CCCC(NC(=O)c3cnc4n3CCCC4)C2=O)cc1
InChIInChI=1S/C20H24N4O2/c1-14-7-9-15(10-8-14)23-12-4-5-16(20(23)26)22-19(25)17-13-21-18-6-2-3-11-24(17)18/h7-10,13,16H,2-6,11-12H2,1H3,(H,22,25)
InChIKeyIVHXDSVRWCPLCH-UHFFFAOYSA-N
MW352.44 g/mol
LogP2.45
Rot. Bonds3

About N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 138995782) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID138995782
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC NameN-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(N2CCCC(NC(=O)c3cnc4n3CCCC4)C2=O)cc1
InChIInChI=1S/C20H24N4O2/c1-14-7-9-15(10-8-14)23-12-4-5-16(20(23)26)22-19(25)17-13-21-18-6-2-3-11-24(17)18/h7-10,13,16H,2-6,11-12H2,1H3,(H,22,25)
InChIKeyIVHXDSVRWCPLCH-UHFFFAOYSA-N
XLogP2.45
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (CID 138995782) is N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc(N2CCCC(NC(=O)c3cnc4n3CCCC4)C2=O)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is IVHXDSVRWCPLCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-14-7-9-15(10-8-14)23-12-4-5-16(20(23)26)22-19(25)17-13-21-18-6-2-3-11-24(17)18/h7-10,13,16H,2-6,11-12H2,1H3,(H,22,25).
What are the key properties of N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)-2-oxopiperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 138995782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).