2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide

C12H23N3O2 — CID 62782342

IUPAC2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide
SMILESCN(C)C(=O)CNC(=O)CC1CCCCC1N
InChIInChI=1S/C12H23N3O2/c1-15(2)12(17)8-14-11(16)7-9-5-3-4-6-10(9)13/h9-10H,3-8,13H2,1-2H3,(H,14,16)
InChIKeyYBJOLKQEVFEWPV-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.10
Rot. Bonds4

About 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide

2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide (PubChem CID 62782342) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide
PubChem CID62782342
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide
SMILESCN(C)C(=O)CNC(=O)CC1CCCCC1N
InChIInChI=1S/C12H23N3O2/c1-15(2)12(17)8-14-11(16)7-9-5-3-4-6-10(9)13/h9-10H,3-8,13H2,1-2H3,(H,14,16)
InChIKeyYBJOLKQEVFEWPV-UHFFFAOYSA-N
XLogP0.10
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide (CID 62782342) is 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide is CN(C)C(=O)CNC(=O)CC1CCCCC1N.
What is the InChIKey of 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide?
The InChIKey is YBJOLKQEVFEWPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-15(2)12(17)8-14-11(16)7-9-5-3-4-6-10(9)13/h9-10H,3-8,13H2,1-2H3,(H,14,16).
What are the key properties of 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide?
2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide has a molecular weight of 241.33 g/mol, XLogP of 0.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminocyclohexyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide is sourced from PubChem (CID 62782342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).