2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride

C15H29ClN2O2 — CID 120783011

IUPAC2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride
SMILESCl.NC(C(=O)NC1CCCCCCC1)C1CCOCC1
InChIInChI=1S/C15H28N2O2.ClH/c16-14(12-8-10-19-11-9-12)15(18)17-13-6-4-2-1-3-5-7-13;/h12-14H,1-11,16H2,(H,17,18);1H
InChIKeyQHQUZJMGHNBVSK-UHFFFAOYSA-N
MW304.86 g/mol
LogP2.39
Rot. Bonds3

About 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride

2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride (PubChem CID 120783011) has the molecular formula C15H29ClN2O2 and a molecular weight of 304.86 g/mol. Its IUPAC name is 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride
PubChem CID120783011
Molecular FormulaC15H29ClN2O2
Molecular Weight304.86 g/mol
Exact Mass304.19
IUPAC Name2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride
SMILESCl.NC(C(=O)NC1CCCCCCC1)C1CCOCC1
InChIInChI=1S/C15H28N2O2.ClH/c16-14(12-8-10-19-11-9-12)15(18)17-13-6-4-2-1-3-5-7-13;/h12-14H,1-11,16H2,(H,17,18);1H
InChIKeyQHQUZJMGHNBVSK-UHFFFAOYSA-N
XLogP2.39
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.86
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 70337031
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CID 120795689
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2-amino-N-(1-cyclopentylethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120792981
2-amino-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120800981
2-amino-N-(3-ethylcyclohexyl)-2-(oxan-4-yl)acetamide
CID 120794016
4-[[2-amino-2-(oxan-4-yl)acetyl]amino]-N-cyclopentylbenzamide
CID 120786530
2-amino-N-(2-cyclohexylethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787635
2-amino-2-(oxan-4-yl)-N-(1-prop-2-enylpiperidin-4-yl)acetamide;dihydrochloride
CID 120800093
2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-3-yl)acetamide;dihydrochloride
CID 120800731
2-amino-N-(4-cyclohexylbutan-2-yl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120793833
2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide
CID 120798994

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride (CID 120783011) is 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride is Cl.NC(C(=O)NC1CCCCCCC1)C1CCOCC1.
What is the InChIKey of 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride?
The InChIKey is QHQUZJMGHNBVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2.ClH/c16-14(12-8-10-19-11-9-12)15(18)17-13-6-4-2-1-3-5-7-13;/h12-14H,1-11,16H2,(H,17,18);1H.
What are the key properties of 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride?
2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride has a molecular weight of 304.86 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride is sourced from PubChem (CID 120783011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).