5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide

C23H23N3O3 — CID 109185242

IUPAC5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(NCC2CCCO2)cn1
InChIInChI=1S/C23H23N3O3/c27-23(22-13-10-18(15-25-22)24-16-21-7-4-14-28-21)26-17-8-11-20(12-9-17)29-19-5-2-1-3-6-19/h1-3,5-6,8-13,15,21,24H,4,7,14,16H2,(H,26,27)
InChIKeyCVUNWRZZRSBRDY-UHFFFAOYSA-N
MW389.46 g/mol
LogP4.72
Rot. Bonds7

About 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide

5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide (PubChem CID 109185242) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
PubChem CID109185242
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(NCC2CCCO2)cn1
InChIInChI=1S/C23H23N3O3/c27-23(22-13-10-18(15-25-22)24-16-21-7-4-14-28-21)26-17-8-11-20(12-9-17)29-19-5-2-1-3-6-19/h1-3,5-6,8-13,15,21,24H,4,7,14,16H2,(H,26,27)
InChIKeyCVUNWRZZRSBRDY-UHFFFAOYSA-N
XLogP4.72
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 54.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(oxolan-2-ylmethylamino)-N-phenylpyridine-2-carboxamide
CID 109185172
2-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyrimidine-5-carboxamide
CID 109252640
N-(2-fluorophenyl)-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185196
5-(oxolan-2-ylmethylamino)-N-(4-piperidin-1-ylphenyl)pyridine-2-carboxamide
CID 109185237
N-(2,5-dimethoxyphenyl)-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185219
N-[(4-methoxyphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185120
5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 109180189
N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185110
N-[(2-chlorophenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185117
N-(oxolan-2-ylmethyl)-4-(4-phenoxyanilino)pyridine-2-carboxamide
CID 109206872
N-[4-(oxolan-2-ylmethylamino)phenyl]-3-phenoxypropanamide
CID 112981200
N-(2,4-dimethylphenyl)-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185179

Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide (CID 109185242) is 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide is O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(NCC2CCCO2)cn1.
What is the InChIKey of 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide?
The InChIKey is CVUNWRZZRSBRDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c27-23(22-13-10-18(15-25-22)24-16-21-7-4-14-28-21)26-17-8-11-20(12-9-17)29-19-5-2-1-3-6-19/h1-3,5-6,8-13,15,21,24H,4,7,14,16H2,(H,26,27).
What are the key properties of 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide?
5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 4.72, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109185242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).