2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide

C15H24N2O2 — CID 96678465

IUPAC2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide
SMILESCOc1cc(C)c(CNC(=O)CN)cc1C(C)(C)C
InChIInChI=1S/C15H24N2O2/c1-10-6-13(19-5)12(15(2,3)4)7-11(10)9-17-14(18)8-16/h6-7H,8-9,16H2,1-5H3,(H,17,18)
InChIKeyNLHFRISDCHYKJZ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.88
Rot. Bonds4

About 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide

2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide (PubChem CID 96678465) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide
PubChem CID96678465
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide
SMILESCOc1cc(C)c(CNC(=O)CN)cc1C(C)(C)C
InChIInChI=1S/C15H24N2O2/c1-10-6-13(19-5)12(15(2,3)4)7-11(10)9-17-14(18)8-16/h6-7H,8-9,16H2,1-5H3,(H,17,18)
InChIKeyNLHFRISDCHYKJZ-UHFFFAOYSA-N
XLogP1.88
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(3-tert-butyl-4-methoxyphenyl)methyl]acetamide
CID 96676289
2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide
CID 82496629
2-amino-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide
CID 60672524
N-[(4-methoxy-2,5-dimethylphenyl)methyl]-3-oxobutanamide
CID 115176376
2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide
CID 115178746
2-amino-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide
CID 82126824
2-amino-N-[(2-bromo-4,5-dimethoxyphenyl)methyl]acetamide;hydrochloride
CID 119316725
1-amino-3-[(4,5-dimethoxy-2-methylphenyl)methyl]urea
CID 115192661
N-[(2,5-dimethoxy-4-methylphenyl)methyl]-3,3-dimethylbutanamide
CID 110783154
N-[(4,5-dimethoxy-2-methylphenyl)methyl]carbamoyl bromide
CID 115193611
N-(2-aminoethyl)-2-(4,5-dimethoxy-2-methylphenyl)acetamide
CID 98016358
N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780829

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide?
The IUPAC name of 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide (CID 96678465) is 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide is COc1cc(C)c(CNC(=O)CN)cc1C(C)(C)C.
What is the InChIKey of 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide?
The InChIKey is NLHFRISDCHYKJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10-6-13(19-5)12(15(2,3)4)7-11(10)9-17-14(18)8-16/h6-7H,8-9,16H2,1-5H3,(H,17,18).
What are the key properties of 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide?
2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide is sourced from PubChem (CID 96678465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).