[4-(4-ethylphenyl)phenyl]methanamine;hydrochloride

C15H18ClN — CID 178203189

IUPAC[4-(4-ethylphenyl)phenyl]methanamine;hydrochloride
SMILESCCc1ccc(-c2ccc(CN)cc2)cc1.Cl
InChIInChI=1S/C15H17N.ClH/c1-2-12-3-7-14(8-4-12)15-9-5-13(11-16)6-10-15;/h3-10H,2,11,16H2,1H3;1H
InChIKeyYJOGBNWOJLVXCP-UHFFFAOYSA-N
MW247.77 g/mol
LogP3.80
Rot. Bonds3

About [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride

[4-(4-ethylphenyl)phenyl]methanamine;hydrochloride (PubChem CID 178203189) has the molecular formula C15H18ClN and a molecular weight of 247.77 g/mol. Its IUPAC name is [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride.

Molecular Properties

Compound Name[4-(4-ethylphenyl)phenyl]methanamine;hydrochloride
PubChem CID178203189
Molecular FormulaC15H18ClN
Molecular Weight247.77 g/mol
Exact Mass247.11
IUPAC Name[4-(4-ethylphenyl)phenyl]methanamine;hydrochloride
SMILESCCc1ccc(-c2ccc(CN)cc2)cc1.Cl
InChIInChI=1S/C15H17N.ClH/c1-2-12-3-7-14(8-4-12)15-9-5-13(11-16)6-10-15;/h3-10H,2,11,16H2,1H3;1H
InChIKeyYJOGBNWOJLVXCP-UHFFFAOYSA-N
XLogP3.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.77
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[4-[4-(2-methylbutan-2-yl)phenyl]phenyl]methanamine
CID 66259187
1,4-bis[(4-ethylphenyl)methyl]benzene;ethane;1-ethyl-4-[[4-[4-[(4-ethylphenyl)methyl]phenyl]phenyl]methyl]benzene
CID 163605506
[4-(4-ethylphenyl)-3-methylphenyl]methanamine
CID 66481033
[4-[4-[4-(4-ethylphenyl)phenyl]phenyl]phenyl]methanethiol
CID 121337523
1-ethyl-4-[4-(4-propylphenyl)phenyl]benzene
CID 58975771
1-ethyl-4-(4-fluorophenyl)benzene
CID 21432911
[4-[4-(4-ethylphenyl)piperazin-1-yl]phenyl]methanamine
CID 71009970
1,4-diethylbenzene;ethane
CID 91207141
alumane;1,4-diethylbenzene
CID 174296012
bicyclo[2.2.0]hexa-1,3,5-triene;ethanamine
CID 22256298
[4-(4-ethylphenyl)-1-methylpyrrol-2-yl]methanamine
CID 117001477
bicyclo[2.2.0]hexa-1,3,5-triene;ethylbenzene
CID 175075360

Frequently Asked Questions

What is the IUPAC name of [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride?
The IUPAC name of [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride (CID 178203189) is [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride.
What is the SMILES notation for [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride?
The canonical SMILES for [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride is CCc1ccc(-c2ccc(CN)cc2)cc1.Cl.
What is the InChIKey of [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride?
The InChIKey is YJOGBNWOJLVXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N.ClH/c1-2-12-3-7-14(8-4-12)15-9-5-13(11-16)6-10-15;/h3-10H,2,11,16H2,1H3;1H.
What are the key properties of [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride?
[4-(4-ethylphenyl)phenyl]methanamine;hydrochloride has a molecular weight of 247.77 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-ethylphenyl)phenyl]methanamine;hydrochloride is sourced from PubChem (CID 178203189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).