N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide

C18H27N3O4S — CID 113071421

IUPACN-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide
SMILESCS(=O)(=O)N(CCNC(=O)C1CCC1)c1ccccc1N1CCOCC1
InChIInChI=1S/C18H27N3O4S/c1-26(23,24)21(10-9-19-18(22)15-5-4-6-15)17-8-3-2-7-16(17)20-11-13-25-14-12-20/h2-3,7-8,15H,4-6,9-14H2,1H3,(H,19,22)
InChIKeyNCHXYZWSFWVMPD-UHFFFAOYSA-N
MW381.50 g/mol
LogP1.21
Rot. Bonds7

About N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide

N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide (PubChem CID 113071421) has the molecular formula C18H27N3O4S and a molecular weight of 381.50 g/mol. Its IUPAC name is N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide
PubChem CID113071421
Molecular FormulaC18H27N3O4S
Molecular Weight381.50 g/mol
Exact Mass381.17
IUPAC NameN-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide
SMILESCS(=O)(=O)N(CCNC(=O)C1CCC1)c1ccccc1N1CCOCC1
InChIInChI=1S/C18H27N3O4S/c1-26(23,24)21(10-9-19-18(22)15-5-4-6-15)17-8-3-2-7-16(17)20-11-13-25-14-12-20/h2-3,7-8,15H,4-6,9-14H2,1H3,(H,19,22)
InChIKeyNCHXYZWSFWVMPD-UHFFFAOYSA-N
XLogP1.21
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.50
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(2-chloro-N-methylsulfonylanilino)ethyl]cyclohexanecarboxamide
CID 113069805
N-cyclopentyl-2-(N-methylsulfonyl-2-morpholin-4-ylanilino)acetamide
CID 113156357
N-[2-(2-tert-butyl-N-methylsulfonylanilino)ethyl]cyclohexanecarboxamide
CID 113069581
N-[2-(2,3-dimethyl-N-methylsulfonylanilino)ethyl]cyclohexanecarboxamide
CID 113069097
N-[2-(2-tert-butyl-N-methylsulfonylanilino)ethyl]cyclopropanecarboxamide
CID 113069578
N-[2-(2,3-dichloro-N-methylsulfonylanilino)ethyl]cyclopropanecarboxamide
CID 113072050
N-[2-(N-methylsulfonyl-2-propan-2-ylanilino)ethyl]oxolane-2-carboxamide
CID 113069347
N-[2-(4-tert-butyl-N-methylsulfonylanilino)ethyl]oxane-4-carboxamide
CID 113069640
N-[2-(2,6-diethyl-N-methylsulfonylanilino)ethyl]cyclopropanecarboxamide
CID 113069505
N-[2-(3-methoxy-N-methylsulfonylanilino)ethyl]cyclobutanecarboxamide
CID 113070461
N-[2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]ethyl]cyclobutanecarboxamide
CID 113071268
N-[2-(4-bromo-3-methyl-N-methylsulfonylanilino)ethyl]cyclobutanecarboxamide
CID 113071622

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide?
The IUPAC name of N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide (CID 113071421) is N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide?
The canonical SMILES for N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide is CS(=O)(=O)N(CCNC(=O)C1CCC1)c1ccccc1N1CCOCC1.
What is the InChIKey of N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide?
The InChIKey is NCHXYZWSFWVMPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O4S/c1-26(23,24)21(10-9-19-18(22)15-5-4-6-15)17-8-3-2-7-16(17)20-11-13-25-14-12-20/h2-3,7-8,15H,4-6,9-14H2,1H3,(H,19,22).
What are the key properties of N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide?
N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide has a molecular weight of 381.50 g/mol, XLogP of 1.21, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-methylsulfonyl-2-morpholin-4-ylanilino)ethyl]cyclobutanecarboxamide is sourced from PubChem (CID 113071421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).