2-(dimethylamino)-N-(3-propoxyphenyl)acetamide

C13H20N2O2 — CID 54843924

IUPAC2-(dimethylamino)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CN(C)C)c1
InChIInChI=1S/C13H20N2O2/c1-4-8-17-12-7-5-6-11(9-12)14-13(16)10-15(2)3/h5-7,9H,4,8,10H2,1-3H3,(H,14,16)
InChIKeyQEVJBFAUICZUBC-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.98
Rot. Bonds6

About 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide

2-(dimethylamino)-N-(3-propoxyphenyl)acetamide (PubChem CID 54843924) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(3-propoxyphenyl)acetamide
PubChem CID54843924
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(dimethylamino)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CN(C)C)c1
InChIInChI=1S/C13H20N2O2/c1-4-8-17-12-7-5-6-11(9-12)14-13(16)10-15(2)3/h5-7,9H,4,8,10H2,1-3H3,(H,14,16)
InChIKeyQEVJBFAUICZUBC-UHFFFAOYSA-N
XLogP1.98
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[2-(dimethylamino)ethoxy]phenyl]butanamide
CID 60776294
2-(ethylamino)-N-(3-propoxyphenyl)acetamide
CID 54820704
N-[3-[[2-(3-propoxyanilino)acetyl]amino]phenyl]propanamide
CID 54825188
2-(4-butoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54820125
N-(3-propoxyphenyl)-N',N'-dipropylpentanediamide
CID 56553165
N-[3-(2-methylprop-2-enoxy)phenyl]-2-(3-propoxyanilino)acetamide
CID 54824758
N-(3-butoxyphenyl)-2-[cyclohexyl(methyl)amino]acetamide
CID 54818028
N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide
CID 36860720
2-(4-methoxyphenyl)-N-(3-propoxyphenyl)acetamide
CID 17096682
ethyl N-(3-propoxyphenyl)carbamate
CID 60643143
N-(3-prop-2-enoxyphenyl)-2-(3-propoxyanilino)acetamide
CID 54824851
N-[3-(2-methoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820051

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide?
The IUPAC name of 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide (CID 54843924) is 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide?
The canonical SMILES for 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide is CCCOc1cccc(NC(=O)CN(C)C)c1.
What is the InChIKey of 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide?
The InChIKey is QEVJBFAUICZUBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-8-17-12-7-5-6-11(9-12)14-13(16)10-15(2)3/h5-7,9H,4,8,10H2,1-3H3,(H,14,16).
What are the key properties of 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide?
2-(dimethylamino)-N-(3-propoxyphenyl)acetamide has a molecular weight of 236.31 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(3-propoxyphenyl)acetamide is sourced from PubChem (CID 54843924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).