2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide

C15H20N2O4S — CID 17070424

IUPAC2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C15H20N2O4S/c1-11-9-14(11)15(18)16-12-3-2-4-13(10-12)22(19,20)17-5-7-21-8-6-17/h2-4,10-11,14H,5-9H2,1H3,(H,16,18)
InChIKeyJXMQOAYCHZOEPJ-UHFFFAOYSA-N
MW324.40 g/mol
LogP1.30
Rot. Bonds4

About 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide

2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide (PubChem CID 17070424) has the molecular formula C15H20N2O4S and a molecular weight of 324.40 g/mol. Its IUPAC name is 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide
PubChem CID17070424
Molecular FormulaC15H20N2O4S
Molecular Weight324.40 g/mol
Exact Mass324.11
IUPAC Name2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C15H20N2O4S/c1-11-9-14(11)15(18)16-12-3-2-4-13(10-12)22(19,20)17-5-7-21-8-6-17/h2-4,10-11,14H,5-9H2,1H3,(H,16,18)
InChIKeyJXMQOAYCHZOEPJ-UHFFFAOYSA-N
XLogP1.30
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.40
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-2,2-dichloro-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide
CID 7925606
(2S)-N-(3-morpholin-4-ylsulfonylphenyl)-5-oxopyrrolidine-2-carboxamide
CID 8008010
1-(3-acetylphenyl)-3-(3-morpholin-4-ylsulfonylphenyl)urea
CID 2956467
2-amino-N-(3-morpholin-4-ylsulfonylphenyl)propanamide
CID 119262356
2-methyl-N-(3-sulfamoylphenyl)cyclopropane-1-carboxamide
CID 47101138
1-methyl-3-(3-morpholin-4-ylsulfonylphenyl)thiourea
CID 19680404
2-methyl-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)cyclopropane-1-carboxamide
CID 5207383
3,5-dimethyl-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 4799420
3,5-dichloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 4800329
4-chloro-N-(3-morpholin-4-ylsulfonylphenyl)benzamide
CID 7759044
N-(3-morpholin-4-ylsulfonylphenyl)-4-propan-2-ylbenzamide
CID 7759072
2-amino-N-(3-morpholin-4-ylsulfonylphenyl)pentanamide
CID 119262364

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide (CID 17070424) is 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide is CC1CC1C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide?
The InChIKey is JXMQOAYCHZOEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4S/c1-11-9-14(11)15(18)16-12-3-2-4-13(10-12)22(19,20)17-5-7-21-8-6-17/h2-4,10-11,14H,5-9H2,1H3,(H,16,18).
What are the key properties of 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide?
2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide has a molecular weight of 324.40 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 17070424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).