N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide

C19H28N2O5S — CID 55588122

IUPACN-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
SMILESCCN(C(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC)C1CCCC1
InChIInChI=1S/C19H28N2O5S/c1-3-21(15-6-4-5-7-15)19(22)17-14-16(8-9-18(17)25-2)27(23,24)20-10-12-26-13-11-20/h8-9,14-15H,3-7,10-13H2,1-2H3
InChIKeyPWAKAHYCLKWBJG-UHFFFAOYSA-N
MW396.51 g/mol
LogP2.12
Rot. Bonds6

About N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide

N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide (PubChem CID 55588122) has the molecular formula C19H28N2O5S and a molecular weight of 396.51 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
PubChem CID55588122
Molecular FormulaC19H28N2O5S
Molecular Weight396.51 g/mol
Exact Mass396.17
IUPAC NameN-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
SMILESCCN(C(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC)C1CCCC1
InChIInChI=1S/C19H28N2O5S/c1-3-21(15-6-4-5-7-15)19(22)17-14-16(8-9-18(17)25-2)27(23,24)20-10-12-26-13-11-20/h8-9,14-15H,3-7,10-13H2,1-2H3
InChIKeyPWAKAHYCLKWBJG-UHFFFAOYSA-N
XLogP2.12
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.51
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide
CID 134059774
N,N-diethyl-2-methoxy-5-piperidin-1-ylsulfonylbenzamide
CID 28590980
2-[(2-methoxy-5-morpholin-4-ylsulfonylbenzoyl)-methylamino]propanoic acid
CID 119358783
[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)methanone
CID 9489943
N-cyclopropyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 26736864
5-amino-N-cyclopentyl-N-ethyl-2-methoxybenzamide
CID 61094826
N-[2-(ethylamino)ethyl]-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 119505913
[(2S)-2-ethyl-1,4-oxazepan-4-yl]-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)methanone
CID 100693385
N-[1-(4-cyanophenyl)ethyl]-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 55592925
5-(azepan-1-ylsulfonyl)-N-(1,1-dioxothiolan-3-yl)-2-methoxy-N-propylbenzamide
CID 24978947
(3,5-dimethylpiperidin-1-yl)-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)methanone
CID 51197836
(2-oxo-2-pyrrolidin-1-ylethyl) 2-methoxy-5-morpholin-4-ylsulfonylbenzoate
CID 8543760

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide (CID 55588122) is N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide is CCN(C(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide?
The InChIKey is PWAKAHYCLKWBJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O5S/c1-3-21(15-6-4-5-7-15)19(22)17-14-16(8-9-18(17)25-2)27(23,24)20-10-12-26-13-11-20/h8-9,14-15H,3-7,10-13H2,1-2H3.
What are the key properties of N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide?
N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide has a molecular weight of 396.51 g/mol, XLogP of 2.12, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 55588122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).