4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide

C24H24N4O3 — CID 155167641

IUPAC4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide
SMILESO=C(NCc1cn2cc(CN3CCCCC3)ccc2n1)c1cc(=O)c2ccccc2o1
InChIInChI=1S/C24H24N4O3/c29-20-12-22(31-21-7-3-2-6-19(20)21)24(30)25-13-18-16-28-15-17(8-9-23(28)26-18)14-27-10-4-1-5-11-27/h2-3,6-9,12,15-16H,1,4-5,10-11,13-14H2,(H,25,30)
InChIKeyTUFPKMAIKQJRHA-UHFFFAOYSA-N
MW416.48 g/mol
LogP3.36
Rot. Bonds5

About 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide

4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide (PubChem CID 155167641) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide.

Molecular Properties

Compound Name4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide
PubChem CID155167641
Molecular FormulaC24H24N4O3
Molecular Weight416.48 g/mol
Exact Mass416.18
IUPAC Name4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide
SMILESO=C(NCc1cn2cc(CN3CCCCC3)ccc2n1)c1cc(=O)c2ccccc2o1
InChIInChI=1S/C24H24N4O3/c29-20-12-22(31-21-7-3-2-6-19(20)21)24(30)25-13-18-16-28-15-17(8-9-23(28)26-18)14-27-10-4-1-5-11-27/h2-3,6-9,12,15-16H,1,4-5,10-11,13-14H2,(H,25,30)
InChIKeyTUFPKMAIKQJRHA-UHFFFAOYSA-N
XLogP3.36
TPSA79.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide
CID 170391703
N-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-5-fluoro-4-oxochromene-2-carboxamide
CID 155167645
N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]-4-oxochromene-2-carboxamide
CID 122353411
4-oxo-N-[(1-pyridin-4-yltriazol-4-yl)methyl]chromene-2-carboxamide
CID 121195822
4-oxo-N-[[1-(thiophen-2-ylmethyl)piperidin-3-yl]methyl]chromene-2-carboxamide
CID 49215023
4-oxo-N-[[5-(4-phenylphenyl)-1,2-oxazol-3-yl]methyl]chromene-2-carboxamide
CID 16867578
N-[[4-(dimethylamino)phenyl]methyl]-4-oxochromene-2-carboxamide
CID 17469485
4-oxo-N-[(3-thiophen-2-ylpyrazin-2-yl)methyl]chromene-2-carboxamide
CID 119106291
N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]-4-oxochromene-2-carboxamide
CID 122318781
N-[[6-[(4-tert-butylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
CID 155167642
6-chloro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-4-oxochromene-2-carboxamide
CID 18775293
N-(2-aminoethyl)-4-oxochromene-2-carboxamide
CID 54880765

Frequently Asked Questions

What is the IUPAC name of 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide?
The IUPAC name of 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide (CID 155167641) is 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide.
What is the SMILES notation for 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide?
The canonical SMILES for 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide is O=C(NCc1cn2cc(CN3CCCCC3)ccc2n1)c1cc(=O)c2ccccc2o1.
What is the InChIKey of 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide?
The InChIKey is TUFPKMAIKQJRHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O3/c29-20-12-22(31-21-7-3-2-6-19(20)21)24(30)25-13-18-16-28-15-17(8-9-23(28)26-18)14-27-10-4-1-5-11-27/h2-3,6-9,12,15-16H,1,4-5,10-11,13-14H2,(H,25,30).
What are the key properties of 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide?
4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide has a molecular weight of 416.48 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-N-[[6-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]chromene-2-carboxamide is sourced from PubChem (CID 155167641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).