2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide

C25H33N5O2 — CID 143685855

IUPAC2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide
SMILESCN(C(=O)Cc1cn2c(C(=O)NCC3CC45CCC4CC35)cccc2n1)C1CCCNC1
InChIInChI=1S/C25H33N5O2/c1-29(19-4-3-9-26-14-19)23(31)11-18-15-30-21(5-2-6-22(30)28-18)24(32)27-13-16-12-25-8-7-17(25)10-20(16)25/h2,5-6,15-17,19-20,26H,3-4,7-14H2,1H3,(H,27,32)
InChIKeyNVJGYYBSDAUZLE-UHFFFAOYSA-N
MW435.57 g/mol
LogP2.25
Rot. Bonds6

About 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide

2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide (PubChem CID 143685855) has the molecular formula C25H33N5O2 and a molecular weight of 435.57 g/mol. Its IUPAC name is 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide.

Molecular Properties

Compound Name2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide
PubChem CID143685855
Molecular FormulaC25H33N5O2
Molecular Weight435.57 g/mol
Exact Mass435.26
IUPAC Name2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide
SMILESCN(C(=O)Cc1cn2c(C(=O)NCC3CC45CCC4CC35)cccc2n1)C1CCCNC1
InChIInChI=1S/C25H33N5O2/c1-29(19-4-3-9-26-14-19)23(31)11-18-15-30-21(5-2-6-22(30)28-18)24(32)27-13-16-12-25-8-7-17(25)10-20(16)25/h2,5-6,15-17,19-20,26H,3-4,7-14H2,1H3,(H,27,32)
InChIKeyNVJGYYBSDAUZLE-UHFFFAOYSA-N
XLogP2.25
TPSA78.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.57
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide?
The IUPAC name of 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide (CID 143685855) is 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide.
What is the SMILES notation for 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide?
The canonical SMILES for 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide is CN(C(=O)Cc1cn2c(C(=O)NCC3CC45CCC4CC35)cccc2n1)C1CCCNC1.
What is the InChIKey of 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide?
The InChIKey is NVJGYYBSDAUZLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N5O2/c1-29(19-4-3-9-26-14-19)23(31)11-18-15-30-21(5-2-6-22(30)28-18)24(32)27-13-16-12-25-8-7-17(25)10-20(16)25/h2,5-6,15-17,19-20,26H,3-4,7-14H2,1H3,(H,27,32).
What are the key properties of 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide?
2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide has a molecular weight of 435.57 g/mol, XLogP of 2.25, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]-N-(3-tricyclo[4.2.0.01,4]octanylmethyl)imidazo[1,2-a]pyridine-5-carboxamide is sourced from PubChem (CID 143685855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).