N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide

C20H34N2O — CID 11638307

IUPACN-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide
SMILESCCN(CC(=O)NC1C2CC3CC(C2)CC1C3)C1CCCCC1
InChIInChI=1S/C20H34N2O/c1-2-22(18-6-4-3-5-7-18)13-19(23)21-20-16-9-14-8-15(11-16)12-17(20)10-14/h14-18,20H,2-13H2,1H3,(H,21,23)
InChIKeyBGFPMHHVINUOLA-UHFFFAOYSA-N
MW318.51 g/mol
LogP3.58
Rot. Bonds5

About N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide

N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide (PubChem CID 11638307) has the molecular formula C20H34N2O and a molecular weight of 318.51 g/mol. Its IUPAC name is N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide
PubChem CID11638307
Molecular FormulaC20H34N2O
Molecular Weight318.51 g/mol
Exact Mass318.27
IUPAC NameN-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide
SMILESCCN(CC(=O)NC1C2CC3CC(C2)CC1C3)C1CCCCC1
InChIInChI=1S/C20H34N2O/c1-2-22(18-6-4-3-5-7-18)13-19(23)21-20-16-9-14-8-15(11-16)12-17(20)10-14/h14-18,20H,2-13H2,1H3,(H,21,23)
InChIKeyBGFPMHHVINUOLA-UHFFFAOYSA-N
XLogP3.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.51
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide?
The IUPAC name of N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide (CID 11638307) is N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide.
What is the SMILES notation for N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide?
The canonical SMILES for N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide is CCN(CC(=O)NC1C2CC3CC(C2)CC1C3)C1CCCCC1.
What is the InChIKey of N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide?
The InChIKey is BGFPMHHVINUOLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34N2O/c1-2-22(18-6-4-3-5-7-18)13-19(23)21-20-16-9-14-8-15(11-16)12-17(20)10-14/h14-18,20H,2-13H2,1H3,(H,21,23).
What are the key properties of N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide?
N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide has a molecular weight of 318.51 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-[cyclohexyl(ethyl)amino]acetamide is sourced from PubChem (CID 11638307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).