4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide

C14H30N4O5S2 — CID 55627166

IUPAC4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide
SMILESCCCN(CCC)S(=O)(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1
InChIInChI=1S/C14H30N4O5S2/c1-3-5-15(6-4-2)24(19,20)16-7-9-17(10-8-16)25(21,22)18-11-13-23-14-12-18/h3-14H2,1-2H3
InChIKeyOQBFBFZCNWOMGS-UHFFFAOYSA-N
MW398.55 g/mol
LogP-0.45
Rot. Bonds8

About 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide

4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide (PubChem CID 55627166) has the molecular formula C14H30N4O5S2 and a molecular weight of 398.55 g/mol. Its IUPAC name is 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide.

Molecular Properties

Compound Name4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide
PubChem CID55627166
Molecular FormulaC14H30N4O5S2
Molecular Weight398.55 g/mol
Exact Mass398.17
IUPAC Name4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide
SMILESCCCN(CCC)S(=O)(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1
InChIInChI=1S/C14H30N4O5S2/c1-3-5-15(6-4-2)24(19,20)16-7-9-17(10-8-16)25(21,22)18-11-13-23-14-12-18/h3-14H2,1-2H3
InChIKeyOQBFBFZCNWOMGS-UHFFFAOYSA-N
XLogP-0.45
TPSA90.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.55
LogP ≤ 5-0.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-butyl-N-(2-chloroethyl)morpholine-4-sulfonamide
CID 63396894
4-[(4-morpholin-4-ylsulfonyl-1,4-diazepan-1-yl)sulfonyl]morpholine
CID 1258870
4-amino-N,N-dipropylpiperidine-1-sulfonamide
CID 43556362
N-(azetidin-3-yl)-N-propylmorpholine-4-sulfonamide
CID 66216682
2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)pentanoic acid
CID 146134852
3-[2-methoxyethyl(morpholin-4-ylsulfonyl)amino]propanethioamide
CID 63285308
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-propylmorpholine-4-sulfonamide
CID 61231913
2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid
CID 62033516
2-[azetidin-1-ylsulfonyl(propyl)amino]acetic acid
CID 122071260
N,N-bis(trimethylsilyl)morpholine-4-sulfonamide
CID 71399815
N-piperidin-4-yl-N-propylmorpholine-4-sulfonamide;hydrochloride
CID 119994019
1-(4-morpholin-4-ylsulfonylpiperazin-1-yl)ethanone
CID 2235310

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide?
The IUPAC name of 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide (CID 55627166) is 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide.
What is the SMILES notation for 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide?
The canonical SMILES for 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide is CCCN(CCC)S(=O)(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1.
What is the InChIKey of 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide?
The InChIKey is OQBFBFZCNWOMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N4O5S2/c1-3-5-15(6-4-2)24(19,20)16-7-9-17(10-8-16)25(21,22)18-11-13-23-14-12-18/h3-14H2,1-2H3.
What are the key properties of 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide?
4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide has a molecular weight of 398.55 g/mol, XLogP of -0.45, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide is sourced from PubChem (CID 55627166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).