N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide

C15H12ClF2N3O — CID 162350144

IUPACN-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide
SMILESO=C(Nc1c(F)cccc1Cl)c1cc(F)cnc1NC1CC1
InChIInChI=1S/C15H12ClF2N3O/c16-11-2-1-3-12(18)13(11)21-15(22)10-6-8(17)7-19-14(10)20-9-4-5-9/h1-3,6-7,9H,4-5H2,(H,19,20)(H,21,22)
InChIKeyOYLWJCFCPWYGKG-UHFFFAOYSA-N
MW323.73 g/mol
LogP3.84
Rot. Bonds4

About N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide

N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide (PubChem CID 162350144) has the molecular formula C15H12ClF2N3O and a molecular weight of 323.73 g/mol. Its IUPAC name is N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide
PubChem CID162350144
Molecular FormulaC15H12ClF2N3O
Molecular Weight323.73 g/mol
Exact Mass323.06
IUPAC NameN-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide
SMILESO=C(Nc1c(F)cccc1Cl)c1cc(F)cnc1NC1CC1
InChIInChI=1S/C15H12ClF2N3O/c16-11-2-1-3-12(18)13(11)21-15(22)10-6-8(17)7-19-14(10)20-9-4-5-9/h1-3,6-7,9H,4-5H2,(H,19,20)(H,21,22)
InChIKeyOYLWJCFCPWYGKG-UHFFFAOYSA-N
XLogP3.84
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.73
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(cyclopropylamino)-N-(2,6-difluorophenyl)pyridine-2-carboxamide
CID 109180224
1-(2-chloro-6-fluorophenyl)-3-cyclopropylurea
CID 108896615
5-chloro-N-(2-chloro-6-fluorophenyl)-2-(methylamino)pyridine-4-carboxamide
CID 114924765
(2-chloro-5-fluoropyridine-3-carbonyl) 2-(cyclopentylamino)-5-fluoropyridine-3-carboxylate
CID 87583158
5-chloro-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide
CID 107372206
N-(2-chloro-6-fluorophenyl)-2-(ethylamino)-3-fluoropyridine-4-carboxamide
CID 105387655
5-amino-N-(2-chloro-6-fluorophenyl)pyrazine-2-carboxamide
CID 107377043
5-cyano-N-[2-(cyclopropylamino)-6-fluorophenyl]pyridine-2-carboxamide
CID 71919813
2-(cyclopropylamino)-N-(2,5-difluorophenyl)pyridine-3-carboxamide
CID 84574316
5-fluoro-2-(thian-4-ylamino)pyridine-3-carboxamide
CID 141190389
N-(2-chloro-6-fluorophenyl)-2-methylsulfanyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 138521565
N-(2-chloro-6-fluorophenyl)-3,5-dihydroxybenzamide
CID 107704313

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide?
The IUPAC name of N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide (CID 162350144) is N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide.
What is the SMILES notation for N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide?
The canonical SMILES for N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide is O=C(Nc1c(F)cccc1Cl)c1cc(F)cnc1NC1CC1.
What is the InChIKey of N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide?
The InChIKey is OYLWJCFCPWYGKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClF2N3O/c16-11-2-1-3-12(18)13(11)21-15(22)10-6-8(17)7-19-14(10)20-9-4-5-9/h1-3,6-7,9H,4-5H2,(H,19,20)(H,21,22).
What are the key properties of N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide?
N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide has a molecular weight of 323.73 g/mol, XLogP of 3.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-fluorophenyl)-2-(cyclopropylamino)-5-fluoropyridine-3-carboxamide is sourced from PubChem (CID 162350144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).