2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine

C15H23NO2 — CID 106200551

IUPAC2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine
SMILESCOc1ccc(C)cc1C(N)COCCC1CC1
InChIInChI=1S/C15H23NO2/c1-11-3-6-15(17-2)13(9-11)14(16)10-18-8-7-12-4-5-12/h3,6,9,12,14H,4-5,7-8,10,16H2,1-2H3
InChIKeyDNFBGQDBPFJIBZ-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.82
Rot. Bonds7

About 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine

2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine (PubChem CID 106200551) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine
PubChem CID106200551
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine
SMILESCOc1ccc(C)cc1C(N)COCCC1CC1
InChIInChI=1S/C15H23NO2/c1-11-3-6-15(17-2)13(9-11)14(16)10-18-8-7-12-4-5-12/h3,6,9,12,14H,4-5,7-8,10,16H2,1-2H3
InChIKeyDNFBGQDBPFJIBZ-UHFFFAOYSA-N
XLogP2.82
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-cyclobutylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 106200897
N-[2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethyl]propan-1-amine
CID 106200526
1-(2-methoxy-5-methylphenyl)-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanamine
CID 115941946
2-heptoxy-1-(2-methoxy-5-methylphenyl)ethanamine
CID 43127467
3-(2,2-difluoroethoxy)-1-(2-methoxy-5-methylphenyl)propan-1-amine
CID 103149128
1-(2-methoxy-5-methylphenyl)-2-(2-methoxyphenoxy)ethanamine
CID 16785142
2-(3,5-dimethylcyclohexyl)oxy-1-(2-methoxy-5-methylphenyl)ethanamine
CID 64728380
(2S)-2-amino-2-(2-methoxy-5-methylphenyl)ethanol
CID 55278412
(1R)-1-(2-methoxy-5-methylphenyl)butan-1-amine
CID 55278250
1-(2-methoxy-5-methylphenyl)-2-(4-methylpentan-2-yloxy)ethanamine
CID 43183961
2-(2-cyclobutylethoxy)-1-(3,5-dimethylphenyl)ethanamine
CID 106200830
1-(2-methoxy-5-methylphenyl)-2-pentan-2-yloxyethanamine
CID 102981344

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine?
The IUPAC name of 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine (CID 106200551) is 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine?
The canonical SMILES for 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine is COc1ccc(C)cc1C(N)COCCC1CC1.
What is the InChIKey of 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine?
The InChIKey is DNFBGQDBPFJIBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11-3-6-15(17-2)13(9-11)14(16)10-18-8-7-12-4-5-12/h3,6,9,12,14H,4-5,7-8,10,16H2,1-2H3.
What are the key properties of 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine?
2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine has a molecular weight of 249.35 g/mol, XLogP of 2.82, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethoxy)-1-(2-methoxy-5-methylphenyl)ethanamine is sourced from PubChem (CID 106200551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).