2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine

C14H21NO — CID 106261295

IUPAC2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine
SMILESCOc1ccccc1CCNCCC1CC1
InChIInChI=1S/C14H21NO/c1-16-14-5-3-2-4-13(14)9-11-15-10-8-12-6-7-12/h2-5,12,15H,6-11H2,1H3
InChIKeyTYLMEUCNLQSGSK-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.63
Rot. Bonds7

About 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine

2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine (PubChem CID 106261295) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine
PubChem CID106261295
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine
SMILESCOc1ccccc1CCNCCC1CC1
InChIInChI=1S/C14H21NO/c1-16-14-5-3-2-4-13(14)9-11-15-10-8-12-6-7-12/h2-5,12,15H,6-11H2,1H3
InChIKeyTYLMEUCNLQSGSK-UHFFFAOYSA-N
XLogP2.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[[2-(2-methoxyphenyl)ethylamino]methyl]cyclohexan-1-amine
CID 115213507
1-methoxy-2-[(4-propylcyclohexyl)methyl]benzene
CID 141394597
1-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]propan-2-amine
CID 103775898
2-(2-methoxyphenyl)-N-[(3-methylcyclohexyl)methyl]ethanamine
CID 106259721
3-[2-(2-methoxyphenyl)ethylamino]propane-1-thiol
CID 115225180
3-methoxy-N-[2-(2-methoxyphenyl)ethyl]propan-1-amine
CID 106261296
4-tert-butyl-N-[2-(2-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 783786
2-(2-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106259714
3-N-[2-(2-methoxyphenyl)ethyl]cyclopentane-1,3-diamine
CID 114165383
1-(cyclopropylmethoxy)-3-[2-(2-methoxyphenyl)ethylamino]propan-2-ol
CID 106261580
N'-[2-(2-methoxyphenyl)ethyl]butane-1,4-diamine
CID 115201470
N-[2-(2-methoxyphenyl)ethyl]-N'-(2-methylpropyl)ethane-1,2-diamine
CID 113405438

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The IUPAC name of 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine (CID 106261295) is 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine.
What is the SMILES notation for 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The canonical SMILES for 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine is COc1ccccc1CCNCCC1CC1.
What is the InChIKey of 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
The InChIKey is TYLMEUCNLQSGSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-16-14-5-3-2-4-13(14)9-11-15-10-8-12-6-7-12/h2-5,12,15H,6-11H2,1H3.
What are the key properties of 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine?
2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine has a molecular weight of 219.33 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine is sourced from PubChem (CID 106261295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).