N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide

C15H30N4O3S — CID 51107039

IUPACN-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide
SMILESCCN1CCC(NC(=O)CN2CCCC(NS(C)(=O)=O)C2)CC1
InChIInChI=1S/C15H30N4O3S/c1-3-18-9-6-13(7-10-18)16-15(20)12-19-8-4-5-14(11-19)17-23(2,21)22/h13-14,17H,3-12H2,1-2H3,(H,16,20)
InChIKeyWQGCLQZYGDLRQB-UHFFFAOYSA-N
MW346.50 g/mol
LogP-0.40
Rot. Bonds6

About N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide

N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide (PubChem CID 51107039) has the molecular formula C15H30N4O3S and a molecular weight of 346.50 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide
PubChem CID51107039
Molecular FormulaC15H30N4O3S
Molecular Weight346.50 g/mol
Exact Mass346.20
IUPAC NameN-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide
SMILESCCN1CCC(NC(=O)CN2CCCC(NS(C)(=O)=O)C2)CC1
InChIInChI=1S/C15H30N4O3S/c1-3-18-9-6-13(7-10-18)16-15(20)12-19-8-4-5-14(11-19)17-23(2,21)22/h13-14,17H,3-12H2,1-2H3,(H,16,20)
InChIKeyWQGCLQZYGDLRQB-UHFFFAOYSA-N
XLogP-0.40
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.50
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide (CID 51107039) is N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide is CCN1CCC(NC(=O)CN2CCCC(NS(C)(=O)=O)C2)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide?
The InChIKey is WQGCLQZYGDLRQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O3S/c1-3-18-9-6-13(7-10-18)16-15(20)12-19-8-4-5-14(11-19)17-23(2,21)22/h13-14,17H,3-12H2,1-2H3,(H,16,20).
What are the key properties of N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide?
N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide has a molecular weight of 346.50 g/mol, XLogP of -0.40, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-2-[3-(methanesulfonamido)piperidin-1-yl]acetamide is sourced from PubChem (CID 51107039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).