3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine

C19H25NO — CID 43099758

IUPAC3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine
SMILESCCCc1ccc(C(N)CCc2ccc(OC)cc2)cc1
InChIInChI=1S/C19H25NO/c1-3-4-15-5-10-17(11-6-15)19(20)14-9-16-7-12-18(21-2)13-8-16/h5-8,10-13,19H,3-4,9,14,20H2,1-2H3
InChIKeyHEXWNCVWMZJNJE-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.28
Rot. Bonds7

About 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine

3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine (PubChem CID 43099758) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine
PubChem CID43099758
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine
SMILESCCCc1ccc(C(N)CCc2ccc(OC)cc2)cc1
InChIInChI=1S/C19H25NO/c1-3-4-15-5-10-17(11-6-15)19(20)14-9-16-7-12-18(21-2)13-8-16/h5-8,10-13,19H,3-4,9,14,20H2,1-2H3
InChIKeyHEXWNCVWMZJNJE-UHFFFAOYSA-N
XLogP4.28
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethanamine;1-methoxy-4-propylbenzene
CID 19382800
ethane;1-methoxy-4-propylbenzene
CID 142085762
1-(4-butylphenyl)-2-(4-methoxyphenyl)ethanamine
CID 43093642
1-[bromo-(4-methoxyphenyl)methyl]-4-propylbenzene
CID 63440600
1-(3-ethylphenyl)-3-(4-methoxyphenyl)propan-1-amine
CID 105018704
3-propoxy-1-(4-propylphenyl)propan-1-amine
CID 105144351
1-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propan-1-amine;hydrochloride
CID 54605246
1-(4-ethoxyphenyl)-3-(4-methylphenyl)propan-1-amine
CID 105140871
1-methoxy-4-[(4-propylphenyl)methyl]benzene
CID 67608407
2-(3-methoxyphenyl)-1-(4-propylphenyl)ethanamine
CID 43198146
1-(4-ethylphenyl)-3-(4-methoxyphenyl)propan-1-ol
CID 61089071
1-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103008702

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine?
The IUPAC name of 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine (CID 43099758) is 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine.
What is the SMILES notation for 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine?
The canonical SMILES for 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine is CCCc1ccc(C(N)CCc2ccc(OC)cc2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine?
The InChIKey is HEXWNCVWMZJNJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-3-4-15-5-10-17(11-6-15)19(20)14-9-16-7-12-18(21-2)13-8-16/h5-8,10-13,19H,3-4,9,14,20H2,1-2H3.
What are the key properties of 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine?
3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine is sourced from PubChem (CID 43099758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).