N,N-diethyl-2-(3-methoxyphenyl)acetamide

C13H19NO2 — CID 23247938

IUPACN,N-diethyl-2-(3-methoxyphenyl)acetamide
SMILESCCN(CC)C(=O)Cc1cccc(OC)c1
InChIInChI=1S/C13H19NO2/c1-4-14(5-2)13(15)10-11-7-6-8-12(9-11)16-3/h6-9H,4-5,10H2,1-3H3
InChIKeyKKLDHNMAEPTSCR-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.11
Rot. Bonds5

About N,N-diethyl-2-(3-methoxyphenyl)acetamide

N,N-diethyl-2-(3-methoxyphenyl)acetamide (PubChem CID 23247938) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N,N-diethyl-2-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-(3-methoxyphenyl)acetamide
PubChem CID23247938
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN,N-diethyl-2-(3-methoxyphenyl)acetamide
SMILESCCN(CC)C(=O)Cc1cccc(OC)c1
InChIInChI=1S/C13H19NO2/c1-4-14(5-2)13(15)10-11-7-6-8-12(9-11)16-3/h6-9H,4-5,10H2,1-3H3
InChIKeyKKLDHNMAEPTSCR-UHFFFAOYSA-N
XLogP2.11
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(3-methoxyphenyl)acetamide?
The IUPAC name of N,N-diethyl-2-(3-methoxyphenyl)acetamide (CID 23247938) is N,N-diethyl-2-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N,N-diethyl-2-(3-methoxyphenyl)acetamide?
The canonical SMILES for N,N-diethyl-2-(3-methoxyphenyl)acetamide is CCN(CC)C(=O)Cc1cccc(OC)c1.
What is the InChIKey of N,N-diethyl-2-(3-methoxyphenyl)acetamide?
The InChIKey is KKLDHNMAEPTSCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-4-14(5-2)13(15)10-11-7-6-8-12(9-11)16-3/h6-9H,4-5,10H2,1-3H3.
What are the key properties of N,N-diethyl-2-(3-methoxyphenyl)acetamide?
N,N-diethyl-2-(3-methoxyphenyl)acetamide has a molecular weight of 221.30 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 23247938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).