2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride

C15H23ClN2O2 — CID 119290193

IUPAC2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride
SMILESCl.NC(C(=O)NCCC1CCOCC1)c1ccccc1
InChIInChI=1S/C15H22N2O2.ClH/c16-14(13-4-2-1-3-5-13)15(18)17-9-6-12-7-10-19-11-8-12;/h1-5,12,14H,6-11,16H2,(H,17,18);1H
InChIKeyINSGNUFODQQAON-UHFFFAOYSA-N
MW298.81 g/mol
LogP2.04
Rot. Bonds5

About 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride

2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride (PubChem CID 119290193) has the molecular formula C15H23ClN2O2 and a molecular weight of 298.81 g/mol. Its IUPAC name is 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride
PubChem CID119290193
Molecular FormulaC15H23ClN2O2
Molecular Weight298.81 g/mol
Exact Mass298.14
IUPAC Name2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride
SMILESCl.NC(C(=O)NCCC1CCOCC1)c1ccccc1
InChIInChI=1S/C15H22N2O2.ClH/c16-14(13-4-2-1-3-5-13)15(18)17-9-6-12-7-10-19-11-8-12;/h1-5,12,14H,6-11,16H2,(H,17,18);1H
InChIKeyINSGNUFODQQAON-UHFFFAOYSA-N
XLogP2.04
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.81
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-cyclopentylethyl)-2-phenylacetamide;hydrochloride
CID 119289820
2-amino-N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride
CID 119885013
(2S)-2-amino-N-[2-(oxan-4-yl)ethyl]-3-phenylpropanamide
CID 119290183
2-amino-N-(2-cyclopropylethyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668581
2-amino-N-(2-morpholin-4-ylethyl)-2-phenylacetamide;dihydrochloride
CID 119827759
2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylpropanamide;hydrochloride
CID 120588866
2-amino-N-[2-(2-methylcyclohexyl)ethyl]-2-phenylacetamide
CID 119323339
3-amino-2-methyl-N-[3-(oxan-4-ylmethoxy)propyl]-3-phenylpropanamide;hydrochloride
CID 119800003
2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120783183
(2R)-2-amino-N-methyl-N-(oxan-4-ylmethyl)-2-phenylacetamide
CID 63706468
(2S)-2-amino-N-[3-(cyclopropylmethoxy)propyl]-2-phenylacetamide
CID 93093422
2-amino-N-[(4-methylsulfanyloxan-4-yl)methyl]-2-phenylacetamide;hydrochloride
CID 119336127

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride (CID 119290193) is 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride is Cl.NC(C(=O)NCCC1CCOCC1)c1ccccc1.
What is the InChIKey of 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride?
The InChIKey is INSGNUFODQQAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2.ClH/c16-14(13-4-2-1-3-5-13)15(18)17-9-6-12-7-10-19-11-8-12;/h1-5,12,14H,6-11,16H2,(H,17,18);1H.
What are the key properties of 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride?
2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride has a molecular weight of 298.81 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 119290193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).