3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine

C15H23NO — CID 106791881

IUPAC3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine
SMILESCNC(CCC1CC1)c1ccc(C)cc1OC
InChIInChI=1S/C15H23NO/c1-11-4-8-13(15(10-11)17-3)14(16-2)9-7-12-5-6-12/h4,8,10,12,14,16H,5-7,9H2,1-3H3
InChIKeyAMQRWWNWMWPLFT-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.45
Rot. Bonds6

About 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine

3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine (PubChem CID 106791881) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine
PubChem CID106791881
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine
SMILESCNC(CCC1CC1)c1ccc(C)cc1OC
InChIInChI=1S/C15H23NO/c1-11-4-8-13(15(10-11)17-3)14(16-2)9-7-12-5-6-12/h4,8,10,12,14,16H,5-7,9H2,1-3H3
InChIKeyAMQRWWNWMWPLFT-UHFFFAOYSA-N
XLogP3.45
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methoxy-4-methylphenyl)-N-methylpent-4-yn-1-amine
CID 106791784
1-(2-methoxy-4-methylphenyl)-N-methyldecan-1-amine
CID 106791994
3-cyclopentyl-1-(2,4-dimethylphenyl)-N-methylpropan-1-amine
CID 43482676
2-(2-bicyclo[2.2.1]heptanyl)-1-(2-methoxy-4-methylphenyl)-N-methylethanamine
CID 106792090
3-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-methylpropan-1-amine
CID 63506516
1-(5-bromo-2-methoxyphenyl)-3-cyclopentyl-N-methylpropan-1-amine
CID 43480073
1-(2-methoxy-5-methylphenyl)-N-methylbutan-1-amine
CID 43626227
1-(5-bromo-4-fluoro-2-methoxyphenyl)-3-cyclopentyl-N-methylpropan-1-amine
CID 103394525
3-methoxy-1-(2-methoxy-5-methylphenyl)-N-methylpropan-1-amine
CID 62797159
3-cyclopentyl-N-methyl-1-(2,4,5-trimethylphenyl)propan-1-amine
CID 104990513
1-(2-methoxy-4-methylphenyl)-N-methyl-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 106791883
2-(4-chloro-2-fluorophenyl)-1-(2-methoxy-4-methylphenyl)-N-methylethanamine
CID 106792155

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine?
The IUPAC name of 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine (CID 106791881) is 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine is CNC(CCC1CC1)c1ccc(C)cc1OC.
What is the InChIKey of 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine?
The InChIKey is AMQRWWNWMWPLFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-4-8-13(15(10-11)17-3)14(16-2)9-7-12-5-6-12/h4,8,10,12,14,16H,5-7,9H2,1-3H3.
What are the key properties of 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine?
3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine has a molecular weight of 233.35 g/mol, XLogP of 3.45, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2-methoxy-4-methylphenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 106791881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).