N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide

C16H26N4O3S — CID 20949627

IUPACN-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide
SMILESCC1CCN(S(=O)(=O)c2cn(CC(=O)NC3CCCC3)cn2)CC1
InChIInChI=1S/C16H26N4O3S/c1-13-6-8-20(9-7-13)24(22,23)16-11-19(12-17-16)10-15(21)18-14-4-2-3-5-14/h11-14H,2-10H2,1H3,(H,18,21)
InChIKeyOEVFHSVCZJVNOX-UHFFFAOYSA-N
MW354.48 g/mol
LogP1.36
Rot. Bonds5

About N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide

N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide (PubChem CID 20949627) has the molecular formula C16H26N4O3S and a molecular weight of 354.48 g/mol. Its IUPAC name is N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide
PubChem CID20949627
Molecular FormulaC16H26N4O3S
Molecular Weight354.48 g/mol
Exact Mass354.17
IUPAC NameN-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide
SMILESCC1CCN(S(=O)(=O)c2cn(CC(=O)NC3CCCC3)cn2)CC1
InChIInChI=1S/C16H26N4O3S/c1-13-6-8-20(9-7-13)24(22,23)16-11-19(12-17-16)10-15(21)18-14-4-2-3-5-14/h11-14H,2-10H2,1H3,(H,18,21)
InChIKeyOEVFHSVCZJVNOX-UHFFFAOYSA-N
XLogP1.36
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide (CID 20949627) is N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide is CC1CCN(S(=O)(=O)c2cn(CC(=O)NC3CCCC3)cn2)CC1.
What is the InChIKey of N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide?
The InChIKey is OEVFHSVCZJVNOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O3S/c1-13-6-8-20(9-7-13)24(22,23)16-11-19(12-17-16)10-15(21)18-14-4-2-3-5-14/h11-14H,2-10H2,1H3,(H,18,21).
What are the key properties of N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide?
N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide has a molecular weight of 354.48 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide is sourced from PubChem (CID 20949627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).