(2,5-dimethylphenyl)-(4-ethylphenyl)methanamine

C17H21N — CID 43198611

IUPAC(2,5-dimethylphenyl)-(4-ethylphenyl)methanamine
SMILESCCc1ccc(C(N)c2cc(C)ccc2C)cc1
InChIInChI=1S/C17H21N/c1-4-14-7-9-15(10-8-14)17(18)16-11-12(2)5-6-13(16)3/h5-11,17H,4,18H2,1-3H3
InChIKeyDHTXKPZJKCSGAV-UHFFFAOYSA-N
MW239.36 g/mol
LogP3.91
Rot. Bonds3

About (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine

(2,5-dimethylphenyl)-(4-ethylphenyl)methanamine (PubChem CID 43198611) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine.

Molecular Properties

Compound Name(2,5-dimethylphenyl)-(4-ethylphenyl)methanamine
PubChem CID43198611
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC Name(2,5-dimethylphenyl)-(4-ethylphenyl)methanamine
SMILESCCc1ccc(C(N)c2cc(C)ccc2C)cc1
InChIInChI=1S/C17H21N/c1-4-14-7-9-15(10-8-14)17(18)16-11-12(2)5-6-13(16)3/h5-11,17H,4,18H2,1-3H3
InChIKeyDHTXKPZJKCSGAV-UHFFFAOYSA-N
XLogP3.91
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-bromo-5-methylphenyl)-(4-ethylphenyl)methanamine
CID 81109837
(2,5-dimethylphenyl)-(3-ethylphenyl)methanamine
CID 105018566
(4-ethylphenyl)-(2-methyl-5-nitrophenyl)methanamine
CID 43825316
(2,5-dimethylphenyl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43093702
(2-bromo-5-methylphenyl)-(4-butylphenyl)methanamine
CID 81111134
2-(2,4-dimethylphenyl)sulfanyl-1-(4-ethylphenyl)ethanamine
CID 64619551
2-chloro-1-(2,5-dimethylphenyl)ethanamine
CID 116937497
1-(2,5-dimethylphenyl)propane-1,3-diamine
CID 116932732
(2,5-dimethylphenyl)-(5-ethoxy-3-pyridinyl)methanamine
CID 105026374
1-(2,5-dimethylphenyl)-2-(4-fluorophenyl)ethanamine
CID 43198585
1-(2,5-dimethylphenyl)butane-1,3-diamine
CID 116933200
(5-chloro-2-methylphenyl)-(4-chlorophenyl)methanamine
CID 79016195

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine?
The IUPAC name of (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine (CID 43198611) is (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine.
What is the SMILES notation for (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine?
The canonical SMILES for (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine is CCc1ccc(C(N)c2cc(C)ccc2C)cc1.
What is the InChIKey of (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine?
The InChIKey is DHTXKPZJKCSGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N/c1-4-14-7-9-15(10-8-14)17(18)16-11-12(2)5-6-13(16)3/h5-11,17H,4,18H2,1-3H3.
What are the key properties of (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine?
(2,5-dimethylphenyl)-(4-ethylphenyl)methanamine has a molecular weight of 239.36 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylphenyl)-(4-ethylphenyl)methanamine is sourced from PubChem (CID 43198611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).