2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine

C19H25NO — CID 43095852

IUPAC2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine
SMILESCOc1cccc(CC(N)c2ccc(CC(C)C)cc2)c1
InChIInChI=1S/C19H25NO/c1-14(2)11-15-7-9-17(10-8-15)19(20)13-16-5-4-6-18(12-16)21-3/h4-10,12,14,19H,11,13,20H2,1-3H3
InChIKeyBRICOLCYTXCPEC-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.14
Rot. Bonds6

About 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine

2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine (PubChem CID 43095852) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine
PubChem CID43095852
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine
SMILESCOc1cccc(CC(N)c2ccc(CC(C)C)cc2)c1
InChIInChI=1S/C19H25NO/c1-14(2)11-15-7-9-17(10-8-15)19(20)13-16-5-4-6-18(12-16)21-3/h4-10,12,14,19H,11,13,20H2,1-3H3
InChIKeyBRICOLCYTXCPEC-UHFFFAOYSA-N
XLogP4.14
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methoxyphenyl)-1-(4-propylphenyl)ethanamine
CID 43198146
(1S)-1,2-bis(3-methoxyphenyl)ethanamine
CID 40618709
1,2-bis(3-methoxyphenyl)ethanamine;hydrochloride
CID 54599738
2-(3-methoxyphenyl)-1-(4-propoxyphenyl)ethanamine
CID 62796466
1-(3-fluoro-4-methylphenyl)-2-(3-methoxyphenyl)ethanamine
CID 61078688
2-(3-methoxyphenyl)-1-(6-methyl-3-pyridinyl)ethanamine
CID 63155644
2-(3-methoxyphenyl)-1-pyridin-3-ylethanamine
CID 22299530
2-(3-bromophenyl)-1-(4-methoxyphenyl)ethanamine
CID 60798720
(4-methoxyphenyl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116543817
1-[3-(2-methylpropyl)phenyl]-2-phenylethanamine
CID 116543879
4-(3-methoxyphenyl)-3-methylbutan-2-amine
CID 60995099
2-(3-methoxyphenyl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 42997257

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine?
The IUPAC name of 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine (CID 43095852) is 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine.
What is the SMILES notation for 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine?
The canonical SMILES for 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine is COc1cccc(CC(N)c2ccc(CC(C)C)cc2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine?
The InChIKey is BRICOLCYTXCPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-14(2)11-15-7-9-17(10-8-15)19(20)13-16-5-4-6-18(12-16)21-3/h4-10,12,14,19H,11,13,20H2,1-3H3.
What are the key properties of 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine?
2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine has a molecular weight of 283.42 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-1-[4-(2-methylpropyl)phenyl]ethanamine is sourced from PubChem (CID 43095852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).