(3-ethoxyphenyl)-(3-methylphenyl)methanamine

C16H19NO — CID 60798038

IUPAC(3-ethoxyphenyl)-(3-methylphenyl)methanamine
SMILESCCOc1cccc(C(N)c2cccc(C)c2)c1
InChIInChI=1S/C16H19NO/c1-3-18-15-9-5-8-14(11-15)16(17)13-7-4-6-12(2)10-13/h4-11,16H,3,17H2,1-2H3
InChIKeyUCSRKOGGRQQHKX-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.44
Rot. Bonds4

About (3-ethoxyphenyl)-(3-methylphenyl)methanamine

(3-ethoxyphenyl)-(3-methylphenyl)methanamine (PubChem CID 60798038) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is (3-ethoxyphenyl)-(3-methylphenyl)methanamine.

Molecular Properties

Compound Name(3-ethoxyphenyl)-(3-methylphenyl)methanamine
PubChem CID60798038
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name(3-ethoxyphenyl)-(3-methylphenyl)methanamine
SMILESCCOc1cccc(C(N)c2cccc(C)c2)c1
InChIInChI=1S/C16H19NO/c1-3-18-15-9-5-8-14(11-15)16(17)13-7-4-6-12(2)10-13/h4-11,16H,3,17H2,1-2H3
InChIKeyUCSRKOGGRQQHKX-UHFFFAOYSA-N
XLogP3.44
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-ethoxyphenyl)-(3-iodophenyl)methanamine
CID 105022183
(3-ethoxyphenyl)-(3-fluorophenyl)methanamine
CID 60798040
(3-ethoxyphenyl)-(6-methyl-3-pyridinyl)methanamine
CID 63156095
(3-chloro-4-methylphenyl)-(3-ethoxyphenyl)methanamine
CID 105022224
(3-ethoxyphenyl)-(3-propylphenyl)methanamine
CID 116543834
(2,3-difluoro-4-methylphenyl)-(3-ethoxyphenyl)methanamine
CID 107513083
(4-bromo-3-fluorophenyl)-(3-ethoxyphenyl)methanamine
CID 105022404
(1S)-1-(3-ethoxyphenyl)-2,2-dimethylpropan-1-amine
CID 94424615
(2,3-difluorophenyl)-(3-ethoxyphenyl)methanamine
CID 63987975
ethane;1-ethoxy-3-methylbenzene;methanol
CID 142994688
1-(3-ethoxyphenyl)-2-methylbutan-1-amine
CID 79444348
(1R)-1-(3-ethoxyphenyl)-2-fluoroethanamine;hydrochloride
CID 171225210

Frequently Asked Questions

What is the IUPAC name of (3-ethoxyphenyl)-(3-methylphenyl)methanamine?
The IUPAC name of (3-ethoxyphenyl)-(3-methylphenyl)methanamine (CID 60798038) is (3-ethoxyphenyl)-(3-methylphenyl)methanamine.
What is the SMILES notation for (3-ethoxyphenyl)-(3-methylphenyl)methanamine?
The canonical SMILES for (3-ethoxyphenyl)-(3-methylphenyl)methanamine is CCOc1cccc(C(N)c2cccc(C)c2)c1.
What is the InChIKey of (3-ethoxyphenyl)-(3-methylphenyl)methanamine?
The InChIKey is UCSRKOGGRQQHKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-3-18-15-9-5-8-14(11-15)16(17)13-7-4-6-12(2)10-13/h4-11,16H,3,17H2,1-2H3.
What are the key properties of (3-ethoxyphenyl)-(3-methylphenyl)methanamine?
(3-ethoxyphenyl)-(3-methylphenyl)methanamine has a molecular weight of 241.33 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxyphenyl)-(3-methylphenyl)methanamine is sourced from PubChem (CID 60798038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).