N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide

C23H25N3O3 — CID 109245387

IUPACN-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cncc(Nc2ccccc2OC(C)C)c1
InChIInChI=1S/C23H25N3O3/c1-4-28-21-11-7-5-9-19(21)26-23(27)17-13-18(15-24-14-17)25-20-10-6-8-12-22(20)29-16(2)3/h5-16,25H,4H2,1-3H3,(H,26,27)
InChIKeyRBPUJESKHCZXSD-UHFFFAOYSA-N
MW391.47 g/mol
LogP5.26
Rot. Bonds8

About N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide

N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide (PubChem CID 109245387) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
PubChem CID109245387
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC NameN-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cncc(Nc2ccccc2OC(C)C)c1
InChIInChI=1S/C23H25N3O3/c1-4-28-21-11-7-5-9-19(21)26-23(27)17-13-18(15-24-14-17)25-20-10-6-8-12-22(20)29-16(2)3/h5-16,25H,4H2,1-3H3,(H,26,27)
InChIKeyRBPUJESKHCZXSD-UHFFFAOYSA-N
XLogP5.26
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.47
LogP ≤ 55.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245416
N-(2-tert-butylphenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide
CID 109244010
5-(3,5-dimethylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109243078
N-(2-propan-2-yloxyphenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223094
N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide
CID 109245433
5-(3-chloro-2-methylanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109244694
5-(4-tert-butylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109244073
5-(3-methylanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109241956
5-(3,4-dimethylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109242967
5-(2,6-difluoroanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245567
3-N-(2-ethoxyphenyl)-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101457
N-benzyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109231733

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide (CID 109245387) is N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide is CCOc1ccccc1NC(=O)c1cncc(Nc2ccccc2OC(C)C)c1.
What is the InChIKey of N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide?
The InChIKey is RBPUJESKHCZXSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-4-28-21-11-7-5-9-19(21)26-23(27)17-13-18(15-24-14-17)25-20-10-6-8-12-22(20)29-16(2)3/h5-16,25H,4H2,1-3H3,(H,26,27).
What are the key properties of N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide?
N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide has a molecular weight of 391.47 g/mol, XLogP of 5.26, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109245387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).