[3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine

C17H21N — CID 61034140

IUPAC[3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine
SMILESCc1cc(C)c(C)c(-c2cccc(CN)c2)c1C
InChIInChI=1S/C17H21N/c1-11-8-12(2)14(4)17(13(11)3)16-7-5-6-15(9-16)10-18/h5-9H,10,18H2,1-4H3
InChIKeyFNKSCKZFECFUSY-UHFFFAOYSA-N
MW239.36 g/mol
LogP4.05
Rot. Bonds2

About [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine

[3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine (PubChem CID 61034140) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine
PubChem CID61034140
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC Name[3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine
SMILESCc1cc(C)c(C)c(-c2cccc(CN)c2)c1C
InChIInChI=1S/C17H21N/c1-11-8-12(2)14(4)17(13(11)3)16-7-5-6-15(9-16)10-18/h5-9H,10,18H2,1-4H3
InChIKeyFNKSCKZFECFUSY-UHFFFAOYSA-N
XLogP4.05
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[3-(2,4,5-trimethylphenyl)phenyl]methanamine
CID 64985236
[3-(4-methylphenyl)phenyl]methanamine
CID 1392243
[3-(3-propylphenyl)phenyl]methanamine
CID 1392934
[3-[3-(methylaminomethyl)phenyl]phenyl]methanamine
CID 58788121
[3-(5-methylthiophen-3-yl)phenyl]methanamine
CID 65100908
[3-(aminomethyl)phenyl]methanamine;azane
CID 175725248
(3-methylphenyl)methanamine;hydrochloride
CID 18670917
[3-(aminomethyl)phenyl]methanamine;ethane;molecular hydrogen
CID 145400663
[3-(1,2-dimethylindol-5-yl)phenyl]methanamine
CID 116996413
[3-(6-methylquinolin-2-yl)phenyl]methanamine
CID 174921519
[3-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]methanamine
CID 129154957
[3-bromo-5-(2,6-dimethylphenyl)phenyl]methanamine;hydrochloride
CID 166643067

Frequently Asked Questions

What is the IUPAC name of [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine?
The IUPAC name of [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine (CID 61034140) is [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine.
What is the SMILES notation for [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine?
The canonical SMILES for [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine is Cc1cc(C)c(C)c(-c2cccc(CN)c2)c1C.
What is the InChIKey of [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine?
The InChIKey is FNKSCKZFECFUSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N/c1-11-8-12(2)14(4)17(13(11)3)16-7-5-6-15(9-16)10-18/h5-9H,10,18H2,1-4H3.
What are the key properties of [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine?
[3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine has a molecular weight of 239.36 g/mol, XLogP of 4.05, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,3,5,6-tetramethylphenyl)phenyl]methanamine is sourced from PubChem (CID 61034140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).