N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide

C15H23N3O4S — CID 50945849

IUPACN-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide
SMILESCN(C)CCNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C15H23N3O4S/c1-17(2)7-6-16-15(19)13-4-3-5-14(12-13)23(20,21)18-8-10-22-11-9-18/h3-5,12H,6-11H2,1-2H3,(H,16,19)
InChIKeyCWVLPTSUQRWDPD-UHFFFAOYSA-N
MW341.43 g/mol
LogP-0.00
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide

N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide (PubChem CID 50945849) has the molecular formula C15H23N3O4S and a molecular weight of 341.43 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide
PubChem CID50945849
Molecular FormulaC15H23N3O4S
Molecular Weight341.43 g/mol
Exact Mass341.14
IUPAC NameN-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide
SMILESCN(C)CCNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C15H23N3O4S/c1-17(2)7-6-16-15(19)13-4-3-5-14(12-13)23(20,21)18-8-10-22-11-9-18/h3-5,12H,6-11H2,1-2H3,(H,16,19)
InChIKeyCWVLPTSUQRWDPD-UHFFFAOYSA-N
XLogP-0.00
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide (CID 50945849) is N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide is CN(C)CCNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide?
The InChIKey is CWVLPTSUQRWDPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4S/c1-17(2)7-6-16-15(19)13-4-3-5-14(12-13)23(20,21)18-8-10-22-11-9-18/h3-5,12H,6-11H2,1-2H3,(H,16,19).
What are the key properties of N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide?
N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide has a molecular weight of 341.43 g/mol, XLogP of -0.00, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 50945849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).