N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide

C24H25N3O5S — CID 24501964

IUPACN-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)C1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C24H25N3O5S/c28-22(16-7-9-26(10-8-16)23(29)19-6-3-15-33-19)25-20-17-4-1-2-5-18(17)32-21(20)24(30)27-11-13-31-14-12-27/h1-6,15-16H,7-14H2,(H,25,28)
InChIKeyDPDNPOXKEOVOOH-UHFFFAOYSA-N
MW467.55 g/mol
LogP3.46
Rot. Bonds4

About N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide

N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide (PubChem CID 24501964) has the molecular formula C24H25N3O5S and a molecular weight of 467.55 g/mol. Its IUPAC name is N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
PubChem CID24501964
Molecular FormulaC24H25N3O5S
Molecular Weight467.55 g/mol
Exact Mass467.15
IUPAC NameN-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)C1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C24H25N3O5S/c28-22(16-7-9-26(10-8-16)23(29)19-6-3-15-33-19)25-20-17-4-1-2-5-18(17)32-21(20)24(30)27-11-13-31-14-12-27/h1-6,15-16H,7-14H2,(H,25,28)
InChIKeyDPDNPOXKEOVOOH-UHFFFAOYSA-N
XLogP3.46
TPSA92.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.55
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]oxolane-2-carboxamide
CID 95339435
N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 1075464
2-chloro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
CID 17462897
3-methyl-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-4,5,6,7-tetrahydrobenzotriazole-5-carboxamide
CID 167826223
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]pyridine-4-carboxamide
CID 17419143
3-cyclopropyl-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]propanamide
CID 71931115
N-[2-(4-propylpiperazine-1-carbonyl)-1-benzofuran-3-yl]cyclopentanecarboxamide
CID 20925750
(3S)-3-acetamido-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-3-thiophen-2-ylpropanamide
CID 51476944
N-[2-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl]cyclohexanecarboxamide
CID 20925892
4-fluoro-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]benzamide
CID 7614430
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]furan-3-carboxamide
CID 18102271
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 55448027

Frequently Asked Questions

What is the IUPAC name of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide (CID 24501964) is N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide is O=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)C1CCN(C(=O)c2cccs2)CC1.
What is the InChIKey of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is DPDNPOXKEOVOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O5S/c28-22(16-7-9-26(10-8-16)23(29)19-6-3-15-33-19)25-20-17-4-1-2-5-18(17)32-21(20)24(30)27-11-13-31-14-12-27/h1-6,15-16H,7-14H2,(H,25,28).
What are the key properties of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 467.55 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 24501964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).