N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide

C17H17Cl2N3O — CID 109226051

IUPACN-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide
SMILESO=C(NC1CCCC1)c1cncc(Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C17H17Cl2N3O/c18-12-5-6-15(19)16(8-12)21-14-7-11(9-20-10-14)17(23)22-13-3-1-2-4-13/h5-10,13,21H,1-4H2,(H,22,23)
InChIKeyUSCGANOFFRLQLW-UHFFFAOYSA-N
MW350.25 g/mol
LogP4.80
Rot. Bonds4

About N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide

N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide (PubChem CID 109226051) has the molecular formula C17H17Cl2N3O and a molecular weight of 350.25 g/mol. Its IUPAC name is N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide
PubChem CID109226051
Molecular FormulaC17H17Cl2N3O
Molecular Weight350.25 g/mol
Exact Mass349.07
IUPAC NameN-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide
SMILESO=C(NC1CCCC1)c1cncc(Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C17H17Cl2N3O/c18-12-5-6-15(19)16(8-12)21-14-7-11(9-20-10-14)17(23)22-13-3-1-2-4-13/h5-10,13,21H,1-4H2,(H,22,23)
InChIKeyUSCGANOFFRLQLW-UHFFFAOYSA-N
XLogP4.80
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.25
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-5-(3,4-dichloroanilino)pyridine-3-carboxamide
CID 109226796
N-cyclopentyl-5-(3,5-dichloroanilino)pyridine-3-carboxamide
CID 109226052
N-cyclopentyl-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109225985
N-cyclohexyl-5-(2,4-difluoroanilino)pyridine-3-carboxamide
CID 109226790
5-(3-chloro-4-fluoroanilino)-N-cyclopropylpyridine-3-carboxamide
CID 109223675
5-anilino-N-cyclohexylpyridine-3-carboxamide
CID 109226711
N-cyclopropyl-5-(2,3,4-trifluoroanilino)pyridine-3-carboxamide
CID 109223746
5-(2,5-dichloroanilino)-N-pentylpyridine-3-carboxamide
CID 109240111
5-N-cyclopentyl-3-N-(3,4-dichlorophenyl)pyridine-3,5-dicarboxamide
CID 109102814
5-(4-acetamidoanilino)-N-cyclopentylpyridine-3-carboxamide
CID 109226017
5-(cyclopentylamino)-N-cyclopropylpyridine-3-carboxamide
CID 109223558
5-(4-bromo-2-methylanilino)-N-cyclohexylpyridine-3-carboxamide
CID 109226784

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide?
The IUPAC name of N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide (CID 109226051) is N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide is O=C(NC1CCCC1)c1cncc(Nc2cc(Cl)ccc2Cl)c1.
What is the InChIKey of N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide?
The InChIKey is USCGANOFFRLQLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2N3O/c18-12-5-6-15(19)16(8-12)21-14-7-11(9-20-10-14)17(23)22-13-3-1-2-4-13/h5-10,13,21H,1-4H2,(H,22,23).
What are the key properties of N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide?
N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide has a molecular weight of 350.25 g/mol, XLogP of 4.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(2,5-dichloroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109226051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).