6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide

C18H11ClN4O2 — CID 66800670

IUPAC6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide
SMILESN#Cc1cc(Cl)ccc1Oc1ccc(C(=O)Nc2cccnc2)cn1
InChIInChI=1S/C18H11ClN4O2/c19-14-4-5-16(13(8-14)9-20)25-17-6-3-12(10-22-17)18(24)23-15-2-1-7-21-11-15/h1-8,10-11H,(H,23,24)
InChIKeyIYWNQLKOAGDQBV-UHFFFAOYSA-N
MW350.77 g/mol
LogP4.05
Rot. Bonds4

About 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide

6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide (PubChem CID 66800670) has the molecular formula C18H11ClN4O2 and a molecular weight of 350.77 g/mol. Its IUPAC name is 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide
PubChem CID66800670
Molecular FormulaC18H11ClN4O2
Molecular Weight350.77 g/mol
Exact Mass350.06
IUPAC Name6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide
SMILESN#Cc1cc(Cl)ccc1Oc1ccc(C(=O)Nc2cccnc2)cn1
InChIInChI=1S/C18H11ClN4O2/c19-14-4-5-16(13(8-14)9-20)25-17-6-3-12(10-22-17)18(24)23-15-2-1-7-21-11-15/h1-8,10-11H,(H,23,24)
InChIKeyIYWNQLKOAGDQBV-UHFFFAOYSA-N
XLogP4.05
TPSA87.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.77
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-nitrophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide
CID 59607215
4-[(4-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide
CID 38754764
3,5-dichloro-N-pyridin-3-ylbenzamide
CID 1245821
N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-4-methylbenzamide
CID 40541033
N-(3-chloro-4-cyanophenyl)-6-methoxypyridine-3-carboxamide
CID 134015998
N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide
CID 18419514
3-fluoro-4-methoxy-N-pyridin-3-ylbenzamide
CID 25343484
N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride
CID 44641711
6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide
CID 175906033
4-(4-chlorophenyl)sulfonyl-N-pyridin-3-ylbenzamide
CID 1117984
4-fluoro-3-nitro-N-pyridin-3-ylbenzamide
CID 43215734
N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide
CID 30779619

Frequently Asked Questions

What is the IUPAC name of 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide?
The IUPAC name of 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide (CID 66800670) is 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide?
The canonical SMILES for 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide is N#Cc1cc(Cl)ccc1Oc1ccc(C(=O)Nc2cccnc2)cn1.
What is the InChIKey of 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide?
The InChIKey is IYWNQLKOAGDQBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClN4O2/c19-14-4-5-16(13(8-14)9-20)25-17-6-3-12(10-22-17)18(24)23-15-2-1-7-21-11-15/h1-8,10-11H,(H,23,24).
What are the key properties of 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide?
6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide has a molecular weight of 350.77 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide is sourced from PubChem (CID 66800670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).