N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide

C15H15Cl2N3O — CID 109223537

IUPACN-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCC(C)Nc1cncc(C(=O)Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C15H15Cl2N3O/c1-9(2)19-12-5-10(7-18-8-12)15(21)20-14-6-11(16)3-4-13(14)17/h3-9,19H,1-2H3,(H,20,21)
InChIKeySIKXEAJLIUPADP-UHFFFAOYSA-N
MW324.21 g/mol
LogP4.46
Rot. Bonds4

About N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide

N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide (PubChem CID 109223537) has the molecular formula C15H15Cl2N3O and a molecular weight of 324.21 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide
PubChem CID109223537
Molecular FormulaC15H15Cl2N3O
Molecular Weight324.21 g/mol
Exact Mass323.06
IUPAC NameN-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCC(C)Nc1cncc(C(=O)Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C15H15Cl2N3O/c1-9(2)19-12-5-10(7-18-8-12)15(21)20-14-6-11(16)3-4-13(14)17/h3-9,19H,1-2H3,(H,20,21)
InChIKeySIKXEAJLIUPADP-UHFFFAOYSA-N
XLogP4.46
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide
CID 109223536
N-[4-chloro-2-(trifluoromethyl)phenyl]-5-(propan-2-ylamino)pyridine-3-carboxamide
CID 109223532
N-(2,5-dichlorophenyl)-2-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 109247242
N-(2,5-dichlorophenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225862
N-[2-(4-chlorophenyl)ethyl]-5-(propan-2-ylamino)pyridine-3-carboxamide
CID 109223411
3-N-(2,5-dichlorophenyl)-5-N,5-N-diethylpyridine-3,5-dicarboxamide
CID 109106831
5-N-(2,5-dichlorophenyl)-3-N-prop-2-enylpyridine-3,5-dicarboxamide
CID 109101895
5-(5-chloro-2-methylanilino)-N-propan-2-ylpyridine-3-carboxamide
CID 109223277
5-(propan-2-ylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109223495
N-(2,5-dichlorophenyl)-5-(N-methylanilino)pyridine-3-carboxamide
CID 109242360
N-(2,5-dichlorophenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102983
N-(2,5-dichlorophenyl)-5-(pyridin-2-ylmethylamino)pyridine-3-carboxamide
CID 109235186

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide (CID 109223537) is N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide is CC(C)Nc1cncc(C(=O)Nc2cc(Cl)ccc2Cl)c1.
What is the InChIKey of N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide?
The InChIKey is SIKXEAJLIUPADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2N3O/c1-9(2)19-12-5-10(7-18-8-12)15(21)20-14-6-11(16)3-4-13(14)17/h3-9,19H,1-2H3,(H,20,21).
What are the key properties of N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide?
N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide has a molecular weight of 324.21 g/mol, XLogP of 4.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109223537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).