5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide

C21H19N3O2 — CID 109180189

IUPAC5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(NC2CC2)cn1
InChIInChI=1S/C21H19N3O2/c25-21(20-13-10-17(14-22-20)23-15-6-7-15)24-16-8-11-19(12-9-16)26-18-4-2-1-3-5-18/h1-5,8-15,23H,6-7H2,(H,24,25)
InChIKeyHSJNKUGZLSBTJV-UHFFFAOYSA-N
MW345.40 g/mol
LogP4.70
Rot. Bonds6

About 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide

5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide (PubChem CID 109180189) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
PubChem CID109180189
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(NC2CC2)cn1
InChIInChI=1S/C21H19N3O2/c25-21(20-13-10-17(14-22-20)23-15-6-7-15)24-16-8-11-19(12-9-16)26-18-4-2-1-3-5-18/h1-5,8-15,23H,6-7H2,(H,24,25)
InChIKeyHSJNKUGZLSBTJV-UHFFFAOYSA-N
XLogP4.70
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
CID 109183141
2-(cyclopentylamino)-N-(4-phenoxyphenyl)pyrimidine-4-carboxamide
CID 109297996
5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109180137
5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 109185242
5-(2-methoxyethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 109184158
N-(3-acetamidophenyl)-5-(cyclopropylamino)pyridine-2-carboxamide
CID 109180174
5-(3-methoxypropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 109184521
N-(4-tert-butylphenyl)-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182449
5-(cyclopropylamino)-N-(2,6-difluorophenyl)pyridine-2-carboxamide
CID 109180224
N-(4-phenoxyphenyl)-5-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109191420
N-(2-chlorophenyl)-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182452
5-(cyclohexylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179840

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide (CID 109180189) is 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide is O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(NC2CC2)cn1.
What is the InChIKey of 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide?
The InChIKey is HSJNKUGZLSBTJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c25-21(20-13-10-17(14-22-20)23-15-6-7-15)24-16-8-11-19(12-9-16)26-18-4-2-1-3-5-18/h1-5,8-15,23H,6-7H2,(H,24,25).
What are the key properties of 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide?
5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide has a molecular weight of 345.40 g/mol, XLogP of 4.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109180189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).