5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide

C19H27N5O2 — CID 39147001

IUPAC5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCCCNC(=O)CN1CCC(NC(=O)c2cn3c(C)cccc3n2)CC1
InChIInChI=1S/C19H27N5O2/c1-3-9-20-18(25)13-23-10-7-15(8-11-23)21-19(26)16-12-24-14(2)5-4-6-17(24)22-16/h4-6,12,15H,3,7-11,13H2,1-2H3,(H,20,25)(H,21,26)
InChIKeyJKRFFIBMIHJVKY-UHFFFAOYSA-N
MW357.46 g/mol
LogP1.36
Rot. Bonds6

About 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide

5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 39147001) has the molecular formula C19H27N5O2 and a molecular weight of 357.46 g/mol. Its IUPAC name is 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID39147001
Molecular FormulaC19H27N5O2
Molecular Weight357.46 g/mol
Exact Mass357.22
IUPAC Name5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCCCNC(=O)CN1CCC(NC(=O)c2cn3c(C)cccc3n2)CC1
InChIInChI=1S/C19H27N5O2/c1-3-9-20-18(25)13-23-10-7-15(8-11-23)21-19(26)16-12-24-14(2)5-4-6-17(24)22-16/h4-6,12,15H,3,7-11,13H2,1-2H3,(H,20,25)(H,21,26)
InChIKeyJKRFFIBMIHJVKY-UHFFFAOYSA-N
XLogP1.36
TPSA78.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide (CID 39147001) is 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide is CCCNC(=O)CN1CCC(NC(=O)c2cn3c(C)cccc3n2)CC1.
What is the InChIKey of 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is JKRFFIBMIHJVKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O2/c1-3-9-20-18(25)13-23-10-7-15(8-11-23)21-19(26)16-12-24-14(2)5-4-6-17(24)22-16/h4-6,12,15H,3,7-11,13H2,1-2H3,(H,20,25)(H,21,26).
What are the key properties of 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide?
5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 357.46 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 39147001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).