N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride

C15H27ClN2O2 — CID 16800381

IUPACN-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride
SMILESCN(CCO)CC(=O)NC1C2CC3CC(C2)CC1C3.Cl
InChIInChI=1S/C15H26N2O2.ClH/c1-17(2-3-18)9-14(19)16-15-12-5-10-4-11(7-12)8-13(15)6-10;/h10-13,15,18H,2-9H2,1H3,(H,16,19);1H
InChIKeyBEQXIONOTXABLK-UHFFFAOYSA-N
MW302.85 g/mol
LogP1.27
Rot. Bonds5

About N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride

N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride (PubChem CID 16800381) has the molecular formula C15H27ClN2O2 and a molecular weight of 302.85 g/mol. Its IUPAC name is N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride
PubChem CID16800381
Molecular FormulaC15H27ClN2O2
Molecular Weight302.85 g/mol
Exact Mass302.18
IUPAC NameN-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride
SMILESCN(CCO)CC(=O)NC1C2CC3CC(C2)CC1C3.Cl
InChIInChI=1S/C15H26N2O2.ClH/c1-17(2-3-18)9-14(19)16-15-12-5-10-4-11(7-12)8-13(15)6-10;/h10-13,15,18H,2-9H2,1H3,(H,16,19);1H
InChIKeyBEQXIONOTXABLK-UHFFFAOYSA-N
XLogP1.27
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.85
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride?
The IUPAC name of N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride (CID 16800381) is N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride?
The canonical SMILES for N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride is CN(CCO)CC(=O)NC1C2CC3CC(C2)CC1C3.Cl.
What is the InChIKey of N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride?
The InChIKey is BEQXIONOTXABLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2.ClH/c1-17(2-3-18)9-14(19)16-15-12-5-10-4-11(7-12)8-13(15)6-10;/h10-13,15,18H,2-9H2,1H3,(H,16,19);1H.
What are the key properties of N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride?
N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride has a molecular weight of 302.85 g/mol, XLogP of 1.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-[2-hydroxyethyl(methyl)amino]acetamide;hydrochloride is sourced from PubChem (CID 16800381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).