N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide

C19H29N3O4S — CID 4296426

IUPACN-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide
SMILESCCCC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1
InChIInChI=1S/C19H29N3O4S/c1-2-6-19(23)20-17-15-16(27(24,25)22-11-13-26-14-12-22)7-8-18(17)21-9-4-3-5-10-21/h7-8,15H,2-6,9-14H2,1H3,(H,20,23)
InChIKeyCASVSDFNCGJZHZ-UHFFFAOYSA-N
MW395.53 g/mol
LogP2.44
Rot. Bonds6

About N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide

N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide (PubChem CID 4296426) has the molecular formula C19H29N3O4S and a molecular weight of 395.53 g/mol. Its IUPAC name is N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide.

Molecular Properties

Compound NameN-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide
PubChem CID4296426
Molecular FormulaC19H29N3O4S
Molecular Weight395.53 g/mol
Exact Mass395.19
IUPAC NameN-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide
SMILESCCCC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1
InChIInChI=1S/C19H29N3O4S/c1-2-6-19(23)20-17-15-16(27(24,25)22-11-13-26-14-12-22)7-8-18(17)21-9-4-3-5-10-21/h7-8,15H,2-6,9-14H2,1H3,(H,20,23)
InChIKeyCASVSDFNCGJZHZ-UHFFFAOYSA-N
XLogP2.44
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.53
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)hexanamide
CID 18084204
ethyl 4-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylanilino)-4-oxobutanoate
CID 4005240
N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)hexanamide
CID 26289530
2-chloro-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)acetamide
CID 5092221
N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-3-(2-methylpropoxy)propanamide
CID 55687311
3-ethoxy-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)propanamide
CID 56502010
1-ethyl-3-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)thiourea
CID 4829989
N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)prop-2-enamide
CID 166404561
2-[(2S)-2-methylpiperidin-1-yl]-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)acetamide
CID 41124206
N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-3-(oxolan-2-ylmethoxy)propanamide
CID 55759411
N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)cyclobutanecarboxamide
CID 7551095
2-methyl-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)cyclopropane-1-carboxamide
CID 5207383

Frequently Asked Questions

What is the IUPAC name of N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide?
The IUPAC name of N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide (CID 4296426) is N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide.
What is the SMILES notation for N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide?
The canonical SMILES for N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide is CCCC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1.
What is the InChIKey of N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide?
The InChIKey is CASVSDFNCGJZHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O4S/c1-2-6-19(23)20-17-15-16(27(24,25)22-11-13-26-14-12-22)7-8-18(17)21-9-4-3-5-10-21/h7-8,15H,2-6,9-14H2,1H3,(H,20,23).
What are the key properties of N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide?
N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide has a molecular weight of 395.53 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide is sourced from PubChem (CID 4296426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).