[4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride

C14H16ClNO — CID 71432523

IUPAC[4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride
SMILESCOc1cccc(-c2ccc(CN)cc2)c1.Cl
InChIInChI=1S/C14H15NO.ClH/c1-16-14-4-2-3-13(9-14)12-7-5-11(10-15)6-8-12;/h2-9H,10,15H2,1H3;1H
InChIKeyWEGRUTGWKGCNAY-UHFFFAOYSA-N
MW249.74 g/mol
LogP3.24
Rot. Bonds3

About [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride

[4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride (PubChem CID 71432523) has the molecular formula C14H16ClNO and a molecular weight of 249.74 g/mol. Its IUPAC name is [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride.

Molecular Properties

Compound Name[4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride
PubChem CID71432523
Molecular FormulaC14H16ClNO
Molecular Weight249.74 g/mol
Exact Mass249.09
IUPAC Name[4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride
SMILESCOc1cccc(-c2ccc(CN)cc2)c1.Cl
InChIInChI=1S/C14H15NO.ClH/c1-16-14-4-2-3-13(9-14)12-7-5-11(10-15)6-8-12;/h2-9H,10,15H2,1H3;1H
InChIKeyWEGRUTGWKGCNAY-UHFFFAOYSA-N
XLogP3.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-3-[4-(4-methoxyphenyl)phenyl]benzene
CID 25138852
2-[4-(3-methoxyphenyl)phenyl]ethanol
CID 2759703
1-methoxy-4-[3-(3-methoxyphenyl)phenyl]benzene
CID 66934064
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
[3-(3-methoxyphenyl)-5-(trifluoromethyl)phenyl]methanamine
CID 156612409
2-amino-3-[4-(3-methoxyphenyl)phenyl]propanoic acid
CID 12968475
1-[4-(3-methoxyphenyl)phenyl]propan-1-amine
CID 54911575
[4-[[5-(3-methoxyphenyl)triazol-1-yl]methyl]phenyl]methanamine
CID 82222321
1-methoxy-3-[4-(trifluoromethyl)phenyl]benzene
CID 14468002
[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methanamine;hydrochloride
CID 50998515
[5-(3-methoxyphenyl)furan-2-yl]methanamine
CID 43826373

Frequently Asked Questions

What is the IUPAC name of [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride?
The IUPAC name of [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride (CID 71432523) is [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride.
What is the SMILES notation for [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride?
The canonical SMILES for [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride is COc1cccc(-c2ccc(CN)cc2)c1.Cl.
What is the InChIKey of [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride?
The InChIKey is WEGRUTGWKGCNAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO.ClH/c1-16-14-4-2-3-13(9-14)12-7-5-11(10-15)6-8-12;/h2-9H,10,15H2,1H3;1H.
What are the key properties of [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride?
[4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride has a molecular weight of 249.74 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methoxyphenyl)phenyl]methanamine;hydrochloride is sourced from PubChem (CID 71432523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).