N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide

C23H23ClN4O4 — CID 110120864

IUPACN-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide
SMILESO=C(NCC(=O)N1CCCCC1c1ncc(Cc2ccccc2Cl)o1)c1cncc(O)c1
InChIInChI=1S/C23H23ClN4O4/c24-19-6-2-1-5-15(19)10-18-13-27-23(32-18)20-7-3-4-8-28(20)21(30)14-26-22(31)16-9-17(29)12-25-11-16/h1-2,5-6,9,11-13,20,29H,3-4,7-8,10,14H2,(H,26,31)
InChIKeyHISVCVLFOXUVIQ-UHFFFAOYSA-N
MW454.91 g/mol
LogP3.50
Rot. Bonds6

About N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide

N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide (PubChem CID 110120864) has the molecular formula C23H23ClN4O4 and a molecular weight of 454.91 g/mol. Its IUPAC name is N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide
PubChem CID110120864
Molecular FormulaC23H23ClN4O4
Molecular Weight454.91 g/mol
Exact Mass454.14
IUPAC NameN-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide
SMILESO=C(NCC(=O)N1CCCCC1c1ncc(Cc2ccccc2Cl)o1)c1cncc(O)c1
InChIInChI=1S/C23H23ClN4O4/c24-19-6-2-1-5-15(19)10-18-13-27-23(32-18)20-7-3-4-8-28(20)21(30)14-26-22(31)16-9-17(29)12-25-11-16/h1-2,5-6,9,11-13,20,29H,3-4,7-8,10,14H2,(H,26,31)
InChIKeyHISVCVLFOXUVIQ-UHFFFAOYSA-N
XLogP3.50
TPSA108.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.91
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]acetamide
CID 110120557
N-[2-[(2S)-2-[5-[(4-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]benzamide
CID 129459888
1-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-(2-methoxyphenyl)ethanone
CID 110121378
1-[(2S)-2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-(2-ethylimidazol-1-yl)ethanone
CID 124953644
[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 110120572
N-[2-[(3S)-3-(5-benzyl-1,3-oxazol-2-yl)piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide
CID 125011579
[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]pyrrolidin-1-yl]-pyrimidin-2-ylmethanone
CID 155902667
N-[2-[3-[5-[(4-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide
CID 110119670
1-[(2S)-2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanone
CID 124949387
1-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]pyrrolidin-1-yl]-2-(3-methoxyphenyl)ethanone
CID 110121363
1-[2-[5-[(2-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]propan-1-one
CID 110131538
1-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]-3-methylbenzimidazol-2-one
CID 110120867

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide (CID 110120864) is N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide is O=C(NCC(=O)N1CCCCC1c1ncc(Cc2ccccc2Cl)o1)c1cncc(O)c1.
What is the InChIKey of N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide?
The InChIKey is HISVCVLFOXUVIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23ClN4O4/c24-19-6-2-1-5-15(19)10-18-13-27-23(32-18)20-7-3-4-8-28(20)21(30)14-26-22(31)16-9-17(29)12-25-11-16/h1-2,5-6,9,11-13,20,29H,3-4,7-8,10,14H2,(H,26,31).
What are the key properties of N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide?
N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide has a molecular weight of 454.91 g/mol, XLogP of 3.50, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 110120864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).