5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide

C13H12F2N4O2 — CID 114405362

IUPAC5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(N)c(Nc2ccc(OC(F)F)cc2)n1
InChIInChI=1S/C13H12F2N4O2/c14-13(15)21-8-3-1-7(2-4-8)18-12-9(16)5-6-10(19-12)11(17)20/h1-6,13H,16H2,(H2,17,20)(H,18,19)
InChIKeyYPDZGZQMYVXDFQ-UHFFFAOYSA-N
MW294.26 g/mol
LogP2.11
Rot. Bonds5

About 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide

5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide (PubChem CID 114405362) has the molecular formula C13H12F2N4O2 and a molecular weight of 294.26 g/mol. Its IUPAC name is 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide
PubChem CID114405362
Molecular FormulaC13H12F2N4O2
Molecular Weight294.26 g/mol
Exact Mass294.09
IUPAC Name5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(N)c(Nc2ccc(OC(F)F)cc2)n1
InChIInChI=1S/C13H12F2N4O2/c14-13(15)21-8-3-1-7(2-4-8)18-12-9(16)5-6-10(19-12)11(17)20/h1-6,13H,16H2,(H2,17,20)(H,18,19)
InChIKeyYPDZGZQMYVXDFQ-UHFFFAOYSA-N
XLogP2.11
TPSA103.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.26
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 5-amino-6-(4-methoxyanilino)pyridine-2-carboxylate
CID 114404918
5-amino-6-(4-ethoxyanilino)pyridine-2-carboxylic acid
CID 114404993
5-amino-6-[3-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 114405030
2-N-(cyclopropylmethyl)-4-N-[4-(difluoromethoxy)phenyl]pyrimidine-2,4,5-triamine
CID 166062716
methyl 5-amino-6-(4-chloroanilino)pyridine-2-carboxylate
CID 114405170
5-amino-6-(3-ethylanilino)pyridine-2-carboxamide
CID 114405232
4-[[4-(difluoromethoxy)benzoyl]amino]benzamide
CID 842852
5-amino-6-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 114405028
5-amino-6-(5-bromo-2,4-difluoroanilino)pyridine-2-carboxamide
CID 102854816
5-amino-6-[4-(dimethylamino)anilino]pyridine-2-carboxylic acid
CID 114405561
3,5-dichloro-N-[4-(difluoromethoxy)phenyl]-6-hydrazinylpyridin-2-amine
CID 102762170
1,3-bis[4-(difluoromethoxy)phenyl]urea
CID 11537485

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide?
The IUPAC name of 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide (CID 114405362) is 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide?
The canonical SMILES for 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide is NC(=O)c1ccc(N)c(Nc2ccc(OC(F)F)cc2)n1.
What is the InChIKey of 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide?
The InChIKey is YPDZGZQMYVXDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F2N4O2/c14-13(15)21-8-3-1-7(2-4-8)18-12-9(16)5-6-10(19-12)11(17)20/h1-6,13H,16H2,(H2,17,20)(H,18,19).
What are the key properties of 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide?
5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide has a molecular weight of 294.26 g/mol, XLogP of 2.11, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[4-(difluoromethoxy)anilino]pyridine-2-carboxamide is sourced from PubChem (CID 114405362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).