N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide

C12H24N4O4S — CID 63253133

IUPACN-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
SMILESNCCNC(=O)C1CCCN(S(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C12H24N4O4S/c13-3-4-14-12(17)11-2-1-5-16(10-11)21(18,19)15-6-8-20-9-7-15/h11H,1-10,13H2,(H,14,17)
InChIKeyLRPPCQVSZKUHPQ-UHFFFAOYSA-N
MW320.42 g/mol
LogP-1.65
Rot. Bonds5

About N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide

N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide (PubChem CID 63253133) has the molecular formula C12H24N4O4S and a molecular weight of 320.42 g/mol. Its IUPAC name is N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
PubChem CID63253133
Molecular FormulaC12H24N4O4S
Molecular Weight320.42 g/mol
Exact Mass320.15
IUPAC NameN-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
SMILESNCCNC(=O)C1CCCN(S(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C12H24N4O4S/c13-3-4-14-12(17)11-2-1-5-16(10-11)21(18,19)15-6-8-20-9-7-15/h11H,1-10,13H2,(H,14,17)
InChIKeyLRPPCQVSZKUHPQ-UHFFFAOYSA-N
XLogP-1.65
TPSA104.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 5-1.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-1-morpholin-4-ylsulfonyl-N-(3-propan-2-yloxypropyl)piperidine-3-carboxamide
CID 92686965
N-(2-aminoethyl)-1-(methylsulfamoyl)piperidine-3-carboxamide
CID 114810707
N-cyclohexyl-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
CID 22552797
(3R)-N-[(2-chlorophenyl)methyl]-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
CID 92686919
(3S)-N-[3-(4-benzylpiperidin-1-yl)propyl]-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
CID 92686982
N-(2-aminoethyl)-1-(3-methylbutylsulfonyl)piperidine-3-carboxamide
CID 63857526
N-[2-(1H-indol-3-yl)ethyl]-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
CID 22552766
azepan-1-yl-(1-morpholin-4-ylsulfonylpiperidin-3-yl)methanone
CID 22552707
(3R)-1-ethylsulfonyl-N-(3-morpholin-4-ylpropyl)piperidine-3-carboxamide
CID 92696521
N-[(3-bromophenyl)methyl]-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
CID 22552799
N-(2-morpholin-4-ylethyl)-1-pyrrolidin-1-ylsulfonylpiperidine-4-carboxamide
CID 3448160
N-(2-aminoethyl)-1-(2,6-dichlorophenyl)sulfonylpiperidine-3-carboxamide
CID 119971159

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide?
The IUPAC name of N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide (CID 63253133) is N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide is NCCNC(=O)C1CCCN(S(=O)(=O)N2CCOCC2)C1.
What is the InChIKey of N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide?
The InChIKey is LRPPCQVSZKUHPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O4S/c13-3-4-14-12(17)11-2-1-5-16(10-11)21(18,19)15-6-8-20-9-7-15/h11H,1-10,13H2,(H,14,17).
What are the key properties of N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide?
N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide has a molecular weight of 320.42 g/mol, XLogP of -1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide is sourced from PubChem (CID 63253133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).