4-(methoxymethyl)-N,N-dimethylaniline

C10H15NO — CID 11829789

IUPAC4-(methoxymethyl)-N,N-dimethylaniline
SMILESCOCc1ccc(N(C)C)cc1
InChIInChI=1S/C10H15NO/c1-11(2)10-6-4-9(5-7-10)8-12-3/h4-7H,8H2,1-3H3
InChIKeyFMXZGJREFIOBLO-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.90
Rot. Bonds3

About 4-(methoxymethyl)-N,N-dimethylaniline

4-(methoxymethyl)-N,N-dimethylaniline (PubChem CID 11829789) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 4-(methoxymethyl)-N,N-dimethylaniline.

Molecular Properties

Compound Name4-(methoxymethyl)-N,N-dimethylaniline
PubChem CID11829789
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name4-(methoxymethyl)-N,N-dimethylaniline
SMILESCOCc1ccc(N(C)C)cc1
InChIInChI=1S/C10H15NO/c1-11(2)10-6-4-9(5-7-10)8-12-3/h4-7H,8H2,1-3H3
InChIKeyFMXZGJREFIOBLO-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N,N-dimethylaniline?
The IUPAC name of 4-(methoxymethyl)-N,N-dimethylaniline (CID 11829789) is 4-(methoxymethyl)-N,N-dimethylaniline.
What is the SMILES notation for 4-(methoxymethyl)-N,N-dimethylaniline?
The canonical SMILES for 4-(methoxymethyl)-N,N-dimethylaniline is COCc1ccc(N(C)C)cc1.
What is the InChIKey of 4-(methoxymethyl)-N,N-dimethylaniline?
The InChIKey is FMXZGJREFIOBLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-11(2)10-6-4-9(5-7-10)8-12-3/h4-7H,8H2,1-3H3.
What are the key properties of 4-(methoxymethyl)-N,N-dimethylaniline?
4-(methoxymethyl)-N,N-dimethylaniline has a molecular weight of 165.24 g/mol, XLogP of 1.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N,N-dimethylaniline is sourced from PubChem (CID 11829789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).