N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide

C15H20N2O4S — CID 17436529

IUPACN-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide
SMILESO=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1
InChIInChI=1S/C15H20N2O4S/c18-15(13-3-4-13)16-11-12-1-5-14(6-2-12)22(19,20)17-7-9-21-10-8-17/h1-2,5-6,13H,3-4,7-11H2,(H,16,18)
InChIKeyMQNXFRHOUZUTNT-UHFFFAOYSA-N
MW324.40 g/mol
LogP0.73
Rot. Bonds5

About N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide

N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide (PubChem CID 17436529) has the molecular formula C15H20N2O4S and a molecular weight of 324.40 g/mol. Its IUPAC name is N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide
PubChem CID17436529
Molecular FormulaC15H20N2O4S
Molecular Weight324.40 g/mol
Exact Mass324.11
IUPAC NameN-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide
SMILESO=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1
InChIInChI=1S/C15H20N2O4S/c18-15(13-3-4-13)16-11-12-1-5-14(6-2-12)22(19,20)17-7-9-21-10-8-17/h1-2,5-6,13H,3-4,7-11H2,(H,16,18)
InChIKeyMQNXFRHOUZUTNT-UHFFFAOYSA-N
XLogP0.73
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.40
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-tert-butyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclohexane-1-carboxamide
CID 9391433
N-[(4-morpholin-4-ylsulfonylphenyl)methyl]piperidine-4-carboxamide
CID 119271576
N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-1-propanoylpiperidine-3-carboxamide
CID 55856282
(3S)-1-(4-bromophenyl)sulfonyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]piperidine-3-carboxamide
CID 94861826
(3S)-1-(4-methoxyphenyl)sulfonyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]piperidine-3-carboxamide
CID 94861829
1-(4-acetylphenyl)sulfonyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-4-carboxamide
CID 27890193
(3R)-1-(4-methoxyphenyl)sulfonyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]piperidine-3-carboxamide
CID 94861830
1-(benzenesulfonyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]pyrrolidine-2-carboxamide
CID 43058785
N-[2-oxo-2-[(4-piperidin-1-ylsulfonylphenyl)methylamino]ethyl]cyclopropanecarboxamide
CID 55634285
1-(benzenesulfonyl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]piperidine-4-carboxamide
CID 28561875
3-(4-morpholin-4-ylsulfonylphenyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]propanamide
CID 43875203
1-acetyl-N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]piperidine-4-carboxamide
CID 108736634

Frequently Asked Questions

What is the IUPAC name of N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide (CID 17436529) is N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide is O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1.
What is the InChIKey of N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide?
The InChIKey is MQNXFRHOUZUTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4S/c18-15(13-3-4-13)16-11-12-1-5-14(6-2-12)22(19,20)17-7-9-21-10-8-17/h1-2,5-6,13H,3-4,7-11H2,(H,16,18).
What are the key properties of N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide?
N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide has a molecular weight of 324.40 g/mol, XLogP of 0.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-morpholin-4-ylsulfonylphenyl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 17436529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).