N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride

C14H25ClN2O2 — CID 6603275

IUPACN-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride
SMILESCl.O=C(CNCCO)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H24N2O2.ClH/c17-2-1-15-9-13(18)16-14-6-10-3-11(7-14)5-12(4-10)8-14;/h10-12,15,17H,1-9H2,(H,16,18);1H
InChIKeyDGLBQIQUYQNZTO-UHFFFAOYSA-N
MW288.82 g/mol
LogP1.08
Rot. Bonds5

About N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride

N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride (PubChem CID 6603275) has the molecular formula C14H25ClN2O2 and a molecular weight of 288.82 g/mol. Its IUPAC name is N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride
PubChem CID6603275
Molecular FormulaC14H25ClN2O2
Molecular Weight288.82 g/mol
Exact Mass288.16
IUPAC NameN-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride
SMILESCl.O=C(CNCCO)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H24N2O2.ClH/c17-2-1-15-9-13(18)16-14-6-10-3-11(7-14)5-12(4-10)8-14;/h10-12,15,17H,1-9H2,(H,16,18);1H
InChIKeyDGLBQIQUYQNZTO-UHFFFAOYSA-N
XLogP1.08
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.82
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N~1~-1-adamantyl-N~2~-isopropylglycinamide hydrochloride
CID 2870223
N-(adamantan-1-yl)-2-[(2-methoxyethyl)amino]acetamide
CID 658856
N-(adamantyl-1)-2-(2-hydroxyethylamino)acetamide
CID 2100989
2-(Adamantan-1-ylamino)-1-(3-hydroxy-pyrrolidin-1-yl)-ethanone
CID 10858831
N-2-adamantanyl(2-hydroxyethylamino)acetamide
CID 18590767
Cambridge id 6073027
CID 2884549
N~1~-1-adamantyl-N~2~-methylglycinamide hydrochloride
CID 2884550
N-((1r,3r,5r,7r)-adamantan-2-yl)-2-((2-hydroxyethyl)(methyl)amino)acetamide hydrochloride
CID 16800381
N-((1r,3r,5r,7r)-adamantan-2-yl)-2-((2-hydroxyethyl)amino)acetamide hydrochloride
CID 18590766
N-(adamantan-1-yl)-2-[cyclohexyl(2-hydroxyethyl)amino]acetamide
CID 30842228
N-((3s,5s,7s)-adamantan-1-yl)-2-(propylamino)acetamide hydrochloride
CID 2870336
N-((3s,5s,7s)-adamantan-1-yl)-2-((2-methoxyethyl)amino)acetamide hydrochloride
CID 2886591

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride?
The IUPAC name of N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride (CID 6603275) is N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride?
The canonical SMILES for N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride is Cl.O=C(CNCCO)NC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride?
The InChIKey is DGLBQIQUYQNZTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2.ClH/c17-2-1-15-9-13(18)16-14-6-10-3-11(7-14)5-12(4-10)8-14;/h10-12,15,17H,1-9H2,(H,16,18);1H.
What are the key properties of N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride?
N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride has a molecular weight of 288.82 g/mol, XLogP of 1.08, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-2-(2-hydroxyethylamino)acetamide;hydrochloride is sourced from PubChem (CID 6603275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).