N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide

C18H26N2O4S — CID 134059774

IUPACN-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide
SMILESCCN(C(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1CCCC1
InChIInChI=1S/C18H26N2O4S/c1-2-20(16-7-3-4-8-16)18(21)15-6-5-9-17(14-15)25(22,23)19-10-12-24-13-11-19/h5-6,9,14,16H,2-4,7-8,10-13H2,1H3
InChIKeyOMMQNHOKHUYCQN-UHFFFAOYSA-N
MW366.48 g/mol
LogP2.11
Rot. Bonds5

About N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide

N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide (PubChem CID 134059774) has the molecular formula C18H26N2O4S and a molecular weight of 366.48 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide
PubChem CID134059774
Molecular FormulaC18H26N2O4S
Molecular Weight366.48 g/mol
Exact Mass366.16
IUPAC NameN-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide
SMILESCCN(C(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1CCCC1
InChIInChI=1S/C18H26N2O4S/c1-2-20(16-7-3-4-8-16)18(21)15-6-5-9-17(14-15)25(22,23)19-10-12-24-13-11-19/h5-6,9,14,16H,2-4,7-8,10-13H2,1H3
InChIKeyOMMQNHOKHUYCQN-UHFFFAOYSA-N
XLogP2.11
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.48
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-N-cyclopropyl-3-morpholin-4-ylsulfonylbenzamide
CID 52568346
N-cyclooctyl-N-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 60610211
N-(cyclopentylmethyl)-N-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 60603204
N-cyclopentyl-N-ethyl-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 55588122
N-cyclopentyl-N-methyl-3-pyrrolidin-1-ylsulfonylbenzamide
CID 17465764
N-(2-cyanoethyl)-N-(oxan-4-yl)-3-piperidin-1-ylsulfonylbenzamide
CID 56534737
(2-cyclohexylpyrrolidin-1-yl)-(3-morpholin-4-ylsulfonylphenyl)methanone
CID 60534827
ethyl 3-morpholin-4-ylsulfonylbenzoate
CID 793747
N-[4-(diethylamino)phenyl]-3-morpholin-4-ylsulfonylbenzamide
CID 2665791
[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] 3-morpholin-4-ylsulfonylbenzoate
CID 7699389
[2-(diethylamino)-2-oxoethyl] 3-morpholin-4-ylsulfonylbenzoate
CID 7699367
3-morpholin-4-ylsulfonyl-N-(oxolan-2-ylmethyl)benzamide
CID 2963679

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide (CID 134059774) is N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide is CCN(C(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide?
The InChIKey is OMMQNHOKHUYCQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O4S/c1-2-20(16-7-3-4-8-16)18(21)15-6-5-9-17(14-15)25(22,23)19-10-12-24-13-11-19/h5-6,9,14,16H,2-4,7-8,10-13H2,1H3.
What are the key properties of N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide?
N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide has a molecular weight of 366.48 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-3-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 134059774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).