2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide

C13H18N2O2 — CID 54964531

IUPAC2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide
SMILESCOc1ccc(NC(=O)CNC2CC2)cc1C
InChIInChI=1S/C13H18N2O2/c1-9-7-11(5-6-12(9)17-2)15-13(16)8-14-10-3-4-10/h5-7,10,14H,3-4,8H2,1-2H3,(H,15,16)
InChIKeyWNDVQJJNZCNILJ-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.69
Rot. Bonds5

About 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide

2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide (PubChem CID 54964531) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide
PubChem CID54964531
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide
SMILESCOc1ccc(NC(=O)CNC2CC2)cc1C
InChIInChI=1S/C13H18N2O2/c1-9-7-11(5-6-12(9)17-2)15-13(16)8-14-10-3-4-10/h5-7,10,14H,3-4,8H2,1-2H3,(H,15,16)
InChIKeyWNDVQJJNZCNILJ-UHFFFAOYSA-N
XLogP1.69
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]amino]piperidine-1-carboxylate
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1-cyclobutyl-3-(4-methoxy-3-methylphenyl)urea
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CID 79280189
2-(cyclopropylamino)-N-(6-methoxy-3-pyridinyl)acetamide
CID 60688381
2-(cyclopropylamino)-N-(3,4-difluorophenyl)acetamide
CID 60647201
N-(4-methoxy-3-methylphenyl)-2-(2-methoxyphenyl)acetamide
CID 110776428
4-chloro-N-(4-methoxy-3-methylphenyl)butanamide
CID 63308381
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CID 54917835

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide (CID 54964531) is 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide is COc1ccc(NC(=O)CNC2CC2)cc1C.
What is the InChIKey of 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide?
The InChIKey is WNDVQJJNZCNILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-7-11(5-6-12(9)17-2)15-13(16)8-14-10-3-4-10/h5-7,10,14H,3-4,8H2,1-2H3,(H,15,16).
What are the key properties of 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide?
2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide has a molecular weight of 234.30 g/mol, XLogP of 1.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-(4-methoxy-3-methylphenyl)acetamide is sourced from PubChem (CID 54964531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).