bis(4-methylphenyl)-phenylmethoxymethanamine

C22H23NO — CID 154384987

IUPACbis(4-methylphenyl)-phenylmethoxymethanamine
SMILESCc1ccc(C(N)(OCc2ccccc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C22H23NO/c1-17-8-12-20(13-9-17)22(23,21-14-10-18(2)11-15-21)24-16-19-6-4-3-5-7-19/h3-15H,16,23H2,1-2H3
InChIKeyMOMJQQAMBMFEAM-UHFFFAOYSA-N
MW317.43 g/mol
LogP4.68
Rot. Bonds5

About bis(4-methylphenyl)-phenylmethoxymethanamine

bis(4-methylphenyl)-phenylmethoxymethanamine (PubChem CID 154384987) has the molecular formula C22H23NO and a molecular weight of 317.43 g/mol. Its IUPAC name is bis(4-methylphenyl)-phenylmethoxymethanamine.

Molecular Properties

Compound Namebis(4-methylphenyl)-phenylmethoxymethanamine
PubChem CID154384987
Molecular FormulaC22H23NO
Molecular Weight317.43 g/mol
Exact Mass317.18
IUPAC Namebis(4-methylphenyl)-phenylmethoxymethanamine
SMILESCc1ccc(C(N)(OCc2ccccc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C22H23NO/c1-17-8-12-20(13-9-17)22(23,21-14-10-18(2)11-15-21)24-16-19-6-4-3-5-7-19/h3-15H,16,23H2,1-2H3
InChIKeyMOMJQQAMBMFEAM-UHFFFAOYSA-N
XLogP4.68
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[(4-Tert-butylphenyl)-phenyl-methoxy]-2-phenyl-ethanamine
CID 46230929
2-[(3,5-Dimethylphenyl)methoxy]-1-phenylcyclohexan-1-amine
CID 21202079
2-[4-(Methoxymethyl)phenyl]propan-2-amine
CID 117278172
1-phenyl-3H-2-benzofuran-1-amine
CID 14064960
(R,R)-1,4-Bis{(2-amino-2-phenylethoxy)methyl}benzene
CID 53481953
(4-((Benzyloxy)methyl)phenyl)methanamine
CID 16789339
2-([1,1'-Biphenyl]-4-ylmethoxy)-2-phenylethylamine
CID 70682933
N-diphenylphosphoryl-1-ethoxy-2,2,2-trifluoro-1-(3-methylphenyl)ethanamine
CID 102386705
1-Phenyl-1-[[4-(trifluoromethyl)phenyl]methoxy]ethanamine
CID 57100097
alpha-(Trifluoromethyl)-alpha-methoxyphenanthrene-9-methanamine
CID 58611151
1-(1-Fluoroethoxy)-1-phenylethanamine
CID 67503438
1-Butan-2-yloxy-2-(4-fluorophenyl)-1-phenylethanamine
CID 70268686

Frequently Asked Questions

What is the IUPAC name of bis(4-methylphenyl)-phenylmethoxymethanamine?
The IUPAC name of bis(4-methylphenyl)-phenylmethoxymethanamine (CID 154384987) is bis(4-methylphenyl)-phenylmethoxymethanamine.
What is the SMILES notation for bis(4-methylphenyl)-phenylmethoxymethanamine?
The canonical SMILES for bis(4-methylphenyl)-phenylmethoxymethanamine is Cc1ccc(C(N)(OCc2ccccc2)c2ccc(C)cc2)cc1.
What is the InChIKey of bis(4-methylphenyl)-phenylmethoxymethanamine?
The InChIKey is MOMJQQAMBMFEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO/c1-17-8-12-20(13-9-17)22(23,21-14-10-18(2)11-15-21)24-16-19-6-4-3-5-7-19/h3-15H,16,23H2,1-2H3.
What are the key properties of bis(4-methylphenyl)-phenylmethoxymethanamine?
bis(4-methylphenyl)-phenylmethoxymethanamine has a molecular weight of 317.43 g/mol, XLogP of 4.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-methylphenyl)-phenylmethoxymethanamine is sourced from PubChem (CID 154384987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).