N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide

C19H10Cl2F2N2O3 — CID 10432401

IUPACN-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide
SMILESO=C(Nc1c(Cl)cncc1Cl)c1ccc(OC(F)F)c2oc3ccccc3c12
InChIInChI=1S/C19H10Cl2F2N2O3/c20-11-7-24-8-12(21)16(11)25-18(26)10-5-6-14(28-19(22)23)17-15(10)9-3-1-2-4-13(9)27-17/h1-8,19H,(H,24,25,26)
InChIKeyAWILLNLAYMAILJ-UHFFFAOYSA-N
MW423.20 g/mol
LogP6.14
Rot. Bonds4

About N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide

N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide (PubChem CID 10432401) has the molecular formula C19H10Cl2F2N2O3 and a molecular weight of 423.20 g/mol. Its IUPAC name is N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide
PubChem CID10432401
Molecular FormulaC19H10Cl2F2N2O3
Molecular Weight423.20 g/mol
Exact Mass422.00
IUPAC NameN-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide
SMILESO=C(Nc1c(Cl)cncc1Cl)c1ccc(OC(F)F)c2oc3ccccc3c12
InChIInChI=1S/C19H10Cl2F2N2O3/c20-11-7-24-8-12(21)16(11)25-18(26)10-5-6-14(28-19(22)23)17-15(10)9-3-1-2-4-13(9)27-17/h1-8,19H,(H,24,25,26)
InChIKeyAWILLNLAYMAILJ-UHFFFAOYSA-N
XLogP6.14
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.20
LogP ≤ 56.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Oglemilast
CID 11387409
Revamilast
CID 11546664
2-acetyl-N-(3,5-dichloro-4-pyridinyl)-7-methoxy-1-benzofuran-4-carboxamide
CID 9821148
N-(3,5-dichloro-4-pyridinyl)-7-methoxy-2-(methoxymethyl)-1-benzofuran-4-carboxamide
CID 44562326
2-cyano-N-(3,5-dichloro-4-pyridinyl)-7-methoxy-1-benzofuran-4-carboxamide
CID 9799054
2-acetyl-N-(3-chloro-4-pyridinyl)-7-methoxy-1-benzofuran-4-carboxamide
CID 12041814
2-acetyl-N-(2-chloro-3-pyridinyl)-7-methoxy-1-benzofuran-4-carboxamide
CID 12041815
N-(3,5-dichloro-4-pyridinyl)-2-(1-hydroxyethyl)-7-methoxy-1-benzofuran-4-carboxamide
CID 12088761
N-(3,5-dichloro-4-pyridinyl)-2-(2,2-dimethylpropyl)-7-methoxy-1-benzofuran-4-carboxamide
CID 12088765
2-acetyl-7-methoxy-N-pyridin-4-yl-1-benzofuran-4-carboxamide
CID 15887290
N-(3,5-dichloro-4-pyridinyl)-2-ethyl-7-methoxy-1-benzofuran-4-carboxamide
CID 15887291
4-[(3,5-Dichloro-4-pyridyl)carbamoyl]-7-methoxybenzofuran-2-carboxylic Acid
CID 22734135

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide?
The IUPAC name of N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide (CID 10432401) is N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide.
What is the SMILES notation for N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide?
The canonical SMILES for N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide is O=C(Nc1c(Cl)cncc1Cl)c1ccc(OC(F)F)c2oc3ccccc3c12.
What is the InChIKey of N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide?
The InChIKey is AWILLNLAYMAILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H10Cl2F2N2O3/c20-11-7-24-8-12(21)16(11)25-18(26)10-5-6-14(28-19(22)23)17-15(10)9-3-1-2-4-13(9)27-17/h1-8,19H,(H,24,25,26).
What are the key properties of N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide?
N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide has a molecular weight of 423.20 g/mol, XLogP of 6.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-pyridinyl)-4-(difluoromethoxy)dibenzofuran-1-carboxamide is sourced from PubChem (CID 10432401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).