2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide

C15H24N2O2 — CID 115152731

IUPAC2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide
SMILESCOc1ccc(CN(C)C(=O)C(C)(C)N)c(C)c1C
InChIInChI=1S/C15H24N2O2/c1-10-11(2)13(19-6)8-7-12(10)9-17(5)14(18)15(3,4)16/h7-8H,9,16H2,1-6H3
InChIKeyDNWRQJWMNJDHJF-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.01
Rot. Bonds4

About 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide

2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide (PubChem CID 115152731) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide.

Molecular Properties

Compound Name2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide
PubChem CID115152731
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide
SMILESCOc1ccc(CN(C)C(=O)C(C)(C)N)c(C)c1C
InChIInChI=1S/C15H24N2O2/c1-10-11(2)13(19-6)8-7-12(10)9-17(5)14(18)15(3,4)16/h7-8H,9,16H2,1-6H3
InChIKeyDNWRQJWMNJDHJF-UHFFFAOYSA-N
XLogP2.01
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide?
The IUPAC name of 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide (CID 115152731) is 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide.
What is the SMILES notation for 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide?
The canonical SMILES for 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide is COc1ccc(CN(C)C(=O)C(C)(C)N)c(C)c1C.
What is the InChIKey of 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide?
The InChIKey is DNWRQJWMNJDHJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10-11(2)13(19-6)8-7-12(10)9-17(5)14(18)15(3,4)16/h7-8H,9,16H2,1-6H3.
What are the key properties of 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide?
2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide has a molecular weight of 264.37 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(4-methoxy-2,3-dimethylphenyl)methyl]-N,2-dimethylpropanamide is sourced from PubChem (CID 115152731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).