2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide

C12H18N2O — CID 82126466

IUPAC2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide
SMILESCc1cc(C)c(CNC(=O)CN)c(C)c1
InChIInChI=1S/C12H18N2O/c1-8-4-9(2)11(10(3)5-8)7-14-12(15)6-13/h4-5H,6-7,13H2,1-3H3,(H,14,15)
InChIKeyRFIPAZRQVTXHOJ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.19
Rot. Bonds3

About 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide

2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide (PubChem CID 82126466) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide
PubChem CID82126466
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide
SMILESCc1cc(C)c(CNC(=O)CN)c(C)c1
InChIInChI=1S/C12H18N2O/c1-8-4-9(2)11(10(3)5-8)7-14-12(15)6-13/h4-5H,6-7,13H2,1-3H3,(H,14,15)
InChIKeyRFIPAZRQVTXHOJ-UHFFFAOYSA-N
XLogP1.19
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-oxo-N-[(2,4,6-trimethylphenyl)methyl]butanamide
CID 115176374
(2,4,6-trimethylphenyl)methylcarbamic acid
CID 67124074
3-hydroxy-N-[(2,4,6-trimethylphenyl)methyl]propanamide
CID 115139004
2-amino-2-methyl-N-[(2,4,6-trimethylphenyl)methyl]propanamide
CID 83540532
2-(aminomethyl)-3-methyl-N-[(2,4,6-trimethylphenyl)methyl]butanamide
CID 115187544
4-amino-N-[(2-methoxy-4,6-dimethylphenyl)methyl]butanamide
CID 115155305
2-(2-methoxyethylamino)-N-[(2,4,6-trimethylphenyl)methyl]acetamide;hydrochloride
CID 119716132
3-amino-4-oxo-4-[(2,4,6-trimethylphenyl)methylamino]butanoic acid
CID 115181303
2-amino-3-methoxy-N-[(2,4,6-trimethylphenyl)methyl]propanamide
CID 120985346
2-amino-3-methoxy-N-[(2,4,6-trimethylphenyl)methyl]propanamide;hydrochloride
CID 120985345
N-[(2,4,6-trimethylphenyl)methyl]azetidine-3-carboxamide
CID 115158841
2-amino-N-[2-(3,5-dimethylanilino)-2-oxoethyl]acetamide
CID 60848808

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide?
The IUPAC name of 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide (CID 82126466) is 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide.
What is the SMILES notation for 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide?
The canonical SMILES for 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide is Cc1cc(C)c(CNC(=O)CN)c(C)c1.
What is the InChIKey of 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide?
The InChIKey is RFIPAZRQVTXHOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-8-4-9(2)11(10(3)5-8)7-14-12(15)6-13/h4-5H,6-7,13H2,1-3H3,(H,14,15).
What are the key properties of 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide?
2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide has a molecular weight of 206.29 g/mol, XLogP of 1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2,4,6-trimethylphenyl)methyl]acetamide is sourced from PubChem (CID 82126466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).