N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide

C16H25N3O6S — CID 35993608

IUPACN-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
SMILESO=C(NCCCN1CCOCC1)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C16H25N3O6S/c20-16(17-4-1-5-18-6-10-23-11-7-18)14-2-3-15(25-14)26(21,22)19-8-12-24-13-9-19/h2-3H,1,4-13H2,(H,17,20)
InChIKeyNXSRSPHJNWKAAX-UHFFFAOYSA-N
MW387.46 g/mol
LogP-0.25
Rot. Bonds7

About N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide

N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide (PubChem CID 35993608) has the molecular formula C16H25N3O6S and a molecular weight of 387.46 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
PubChem CID35993608
Molecular FormulaC16H25N3O6S
Molecular Weight387.46 g/mol
Exact Mass387.15
IUPAC NameN-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
SMILESO=C(NCCCN1CCOCC1)c1ccc(S(=O)(=O)N2CCOCC2)o1
InChIInChI=1S/C16H25N3O6S/c20-16(17-4-1-5-18-6-10-23-11-7-18)14-2-3-15(25-14)26(21,22)19-8-12-24-13-9-19/h2-3H,1,4-13H2,(H,17,20)
InChIKeyNXSRSPHJNWKAAX-UHFFFAOYSA-N
XLogP-0.25
TPSA101.32 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(dimethylamino)ethyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 110476324
5-morpholin-4-ylsulfonyl-N-(2-phenoxyethyl)furan-2-carboxamide
CID 30233770
4-(chloromethyl)-N-(3-morpholin-4-ylpropyl)benzamide
CID 43168028
1-N,4-N-bis(3-morpholin-4-ylpropyl)benzene-1,4-dicarboxamide;hydrochloride
CID 54609927
N-[(5-ethylthiophen-2-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 46466417
3-[(5-piperidin-1-ylsulfonylfuran-2-carbonyl)amino]propanoic acid
CID 75417895
5-morpholin-4-ylsulfonyl-N-(2,4,6-trimethylphenyl)furan-2-carboxamide
CID 39087927
3,4-dichloro-N-(3-morpholin-4-ylpropyl)benzamide
CID 3328171
N-(2-hydroxyphenyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 84578663
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 112528608
N-(3-morpholin-4-ylpropyl)-3-pyrrolidin-1-ylsulfonylbenzamide
CID 2329278
5-morpholin-4-ylsulfonyl-N-[(3-phenoxyphenyl)methyl]furan-2-carboxamide
CID 39576917

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide (CID 35993608) is N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide is O=C(NCCCN1CCOCC1)c1ccc(S(=O)(=O)N2CCOCC2)o1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
The InChIKey is NXSRSPHJNWKAAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O6S/c20-16(17-4-1-5-18-6-10-23-11-7-18)14-2-3-15(25-14)26(21,22)19-8-12-24-13-9-19/h2-3H,1,4-13H2,(H,17,20).
What are the key properties of N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide?
N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide has a molecular weight of 387.46 g/mol, XLogP of -0.25, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide is sourced from PubChem (CID 35993608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).