N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine

C24H27NO — CID 70697308

IUPACN-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine
SMILESCCN(CC)C(c1ccccc1)(c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C24H27NO/c1-4-25(5-2)24(20-12-8-6-9-13-20,21-14-10-7-11-15-21)22-16-18-23(26-3)19-17-22/h6-19H,4-5H2,1-3H3
InChIKeyPQHFFFHQDULZJO-UHFFFAOYSA-N
MW345.49 g/mol
LogP5.33
Rot. Bonds7

About N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine

N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine (PubChem CID 70697308) has the molecular formula C24H27NO and a molecular weight of 345.49 g/mol. Its IUPAC name is N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine
PubChem CID70697308
Molecular FormulaC24H27NO
Molecular Weight345.49 g/mol
Exact Mass345.21
IUPAC NameN-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine
SMILESCCN(CC)C(c1ccccc1)(c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C24H27NO/c1-4-25(5-2)24(20-12-8-6-9-13-20,21-14-10-7-11-15-21)22-16-18-23(26-3)19-17-22/h6-19H,4-5H2,1-3H3
InChIKeyPQHFFFHQDULZJO-UHFFFAOYSA-N
XLogP5.33
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.49
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine?
The IUPAC name of N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine (CID 70697308) is N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine.
What is the SMILES notation for N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine?
The canonical SMILES for N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine is CCN(CC)C(c1ccccc1)(c1ccccc1)c1ccc(OC)cc1.
What is the InChIKey of N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine?
The InChIKey is PQHFFFHQDULZJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27NO/c1-4-25(5-2)24(20-12-8-6-9-13-20,21-14-10-7-11-15-21)22-16-18-23(26-3)19-17-22/h6-19H,4-5H2,1-3H3.
What are the key properties of N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine?
N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine has a molecular weight of 345.49 g/mol, XLogP of 5.33, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(4-methoxyphenyl)-diphenylmethyl]ethanamine is sourced from PubChem (CID 70697308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).