N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide

C24H23ClN2O4 — CID 147622236

IUPACN-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide
SMILESO=C(CC1CCC(NC(=O)C2Cc3ccncc3O2)CC1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C24H23ClN2O4/c25-17-3-6-20-16(10-17)12-21(30-20)19(28)9-14-1-4-18(5-2-14)27-24(29)22-11-15-7-8-26-13-23(15)31-22/h3,6-8,10,12-14,18,22H,1-2,4-5,9,11H2,(H,27,29)
InChIKeyGECBIADKEOVDEV-UHFFFAOYSA-N
MW438.91 g/mol
LogP4.73
Rot. Bonds5

About N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide

N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide (PubChem CID 147622236) has the molecular formula C24H23ClN2O4 and a molecular weight of 438.91 g/mol. Its IUPAC name is N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide
PubChem CID147622236
Molecular FormulaC24H23ClN2O4
Molecular Weight438.91 g/mol
Exact Mass438.13
IUPAC NameN-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide
SMILESO=C(CC1CCC(NC(=O)C2Cc3ccncc3O2)CC1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C24H23ClN2O4/c25-17-3-6-20-16(10-17)12-21(30-20)19(28)9-14-1-4-18(5-2-14)27-24(29)22-11-15-7-8-26-13-23(15)31-22/h3,6-8,10,12-14,18,22H,1-2,4-5,9,11H2,(H,27,29)
InChIKeyGECBIADKEOVDEV-UHFFFAOYSA-N
XLogP4.73
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.91
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide with MolForge

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Related Compounds

N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]furo[2,3-c]pyridine-2-carboxamide
CID 149388857
N-[4-[[3-(4-chlorophenoxy)-2-hydroxypropyl]amino]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide
CID 160689532
3-(3-aminocyclopentyl)-1-(5-chloro-1-benzofuran-2-yl)propan-1-one
CID 158161250
5-chloro-N-cyclooctyl-1-benzofuran-2-carboxamide
CID 71662787
(2R)-5-chloro-N-cycloheptyl-2,3-dihydro-1-benzofuran-2-carboxamide
CID 8006571
1-(5-chloro-1-benzofuran-2-yl)-2-pyrrolidin-2-ylethanone
CID 114736387
(2R)-5-chloro-N-isoquinolin-5-yl-2,3-dihydro-1-benzofuran-2-carboxamide
CID 39995800
[4-(aminomethyl)cyclohexyl]-(5-chloro-1-benzofuran-2-yl)methanone
CID 114737009
2-[4-[[3-(4-chloro-3-fluorophenoxy)oxetan-3-yl]methylamino]cyclohexyl]-1-(2,3-dihydrofuro[2,3-c]pyridin-2-yl)ethanone
CID 148869860
2-[4-(5-chloro-1-benzofuran-2-carbonyl)piperazin-1-yl]-N-cyclopropylacetamide
CID 31427597
1-(5-chloro-1-benzofuran-2-yl)propan-1-one
CID 65425941
(5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone
CID 58707364

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide (CID 147622236) is N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide is O=C(CC1CCC(NC(=O)C2Cc3ccncc3O2)CC1)c1cc2cc(Cl)ccc2o1.
What is the InChIKey of N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide?
The InChIKey is GECBIADKEOVDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN2O4/c25-17-3-6-20-16(10-17)12-21(30-20)19(28)9-14-1-4-18(5-2-14)27-24(29)22-11-15-7-8-26-13-23(15)31-22/h3,6-8,10,12-14,18,22H,1-2,4-5,9,11H2,(H,27,29).
What are the key properties of N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide?
N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide has a molecular weight of 438.91 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(5-chloro-1-benzofuran-2-yl)-2-oxoethyl]cyclohexyl]-2,3-dihydrofuro[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 147622236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).