2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide

C23H36N2O2 — CID 24947984

IUPAC2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide
SMILESO=C(CC1(CC(=O)NC2C3CC4CC(C3)CC2C4)CCCCC1)NC1CC1
InChIInChI=1S/C23H36N2O2/c26-20(24-19-4-5-19)13-23(6-2-1-3-7-23)14-21(27)25-22-17-9-15-8-16(11-17)12-18(22)10-15/h15-19,22H,1-14H2,(H,24,26)(H,25,27)
InChIKeyYTDAHFUMTFWALA-UHFFFAOYSA-N
MW372.55 g/mol
LogP3.94
Rot. Bonds6

About 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide

2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide (PubChem CID 24947984) has the molecular formula C23H36N2O2 and a molecular weight of 372.55 g/mol. Its IUPAC name is 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide
PubChem CID24947984
Molecular FormulaC23H36N2O2
Molecular Weight372.55 g/mol
Exact Mass372.28
IUPAC Name2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide
SMILESO=C(CC1(CC(=O)NC2C3CC4CC(C3)CC2C4)CCCCC1)NC1CC1
InChIInChI=1S/C23H36N2O2/c26-20(24-19-4-5-19)13-23(6-2-1-3-7-23)14-21(27)25-22-17-9-15-8-16(11-17)12-18(22)10-15/h15-19,22H,1-14H2,(H,24,26)(H,25,27)
InChIKeyYTDAHFUMTFWALA-UHFFFAOYSA-N
XLogP3.94
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.55
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide?
The IUPAC name of 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide (CID 24947984) is 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide?
The canonical SMILES for 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide is O=C(CC1(CC(=O)NC2C3CC4CC(C3)CC2C4)CCCCC1)NC1CC1.
What is the InChIKey of 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide?
The InChIKey is YTDAHFUMTFWALA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H36N2O2/c26-20(24-19-4-5-19)13-23(6-2-1-3-7-23)14-21(27)25-22-17-9-15-8-16(11-17)12-18(22)10-15/h15-19,22H,1-14H2,(H,24,26)(H,25,27).
What are the key properties of 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide?
2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide has a molecular weight of 372.55 g/mol, XLogP of 3.94, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclohexyl]-N-cyclopropylacetamide is sourced from PubChem (CID 24947984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).