2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide

C15H22N2O2 — CID 120782547

IUPAC2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide
SMILESCc1ccc(C)c(NC(=O)C(N)C2CCOCC2)c1
InChIInChI=1S/C15H22N2O2/c1-10-3-4-11(2)13(9-10)17-15(18)14(16)12-5-7-19-8-6-12/h3-4,9,12,14H,5-8,16H2,1-2H3,(H,17,18)
InChIKeyBQONSEAVFBMIQB-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.00
Rot. Bonds3

About 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide

2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide (PubChem CID 120782547) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide
PubChem CID120782547
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide
SMILESCc1ccc(C)c(NC(=O)C(N)C2CCOCC2)c1
InChIInChI=1S/C15H22N2O2/c1-10-3-4-11(2)13(9-10)17-15(18)14(16)12-5-7-19-8-6-12/h3-4,9,12,14H,5-8,16H2,1-2H3,(H,17,18)
InChIKeyBQONSEAVFBMIQB-UHFFFAOYSA-N
XLogP2.00
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120785843
3-[[2-amino-2-(oxan-4-yl)acetyl]amino]-N-cyclopropyl-4-methylbenzamide
CID 120786526
2-amino-N-(4-fluoro-2-methylphenyl)-2-(oxan-4-yl)acetamide
CID 120783512
2-amino-N-(3-methylphenyl)-2-(oxan-4-yl)acetamide
CID 120782660
2-amino-N-(3-iodo-4-methylphenyl)-2-(oxan-4-yl)acetamide
CID 120783594
2-amino-N-(4-methyl-2-pyridinyl)-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120796743
2-amino-N-(4-methyl-3-sulfamoylphenyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120784349
2-amino-2-(oxan-4-yl)-N-(2,4,5-trifluorophenyl)acetamide;hydrochloride
CID 120786077
2-amino-N-[2-(3,5-dimethylphenyl)ethyl]-2-(oxan-4-yl)acetamide
CID 120794628
2-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide
CID 24690389
2-(dicyclopropylmethylamino)-N-(2,5-dimethylphenyl)propanamide
CID 119032237
2-amino-N-(5-methyl-3-pyridinyl)-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120800459

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide?
The IUPAC name of 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide (CID 120782547) is 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide?
The canonical SMILES for 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide is Cc1ccc(C)c(NC(=O)C(N)C2CCOCC2)c1.
What is the InChIKey of 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide?
The InChIKey is BQONSEAVFBMIQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-3-4-11(2)13(9-10)17-15(18)14(16)12-5-7-19-8-6-12/h3-4,9,12,14H,5-8,16H2,1-2H3,(H,17,18).
What are the key properties of 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide?
2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,5-dimethylphenyl)-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 120782547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).