1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine

C15H23NO2 — CID 81370901

IUPAC1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine
SMILESCOCC(N[C@H](C)c1ccc(OC)cc1)C1CC1
InChIInChI=1S/C15H23NO2/c1-11(12-6-8-14(18-3)9-7-12)16-15(10-17-2)13-4-5-13/h6-9,11,13,15-16H,4-5,10H2,1-3H3/t11-,15?/m1/s1
InChIKeyYJBRXZKFJONFSF-ZRKZCGFPSA-N
MW249.35 g/mol
LogP2.77
Rot. Bonds7

About 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine

1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine (PubChem CID 81370901) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine
PubChem CID81370901
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine
SMILESCOCC(N[C@H](C)c1ccc(OC)cc1)C1CC1
InChIInChI=1S/C15H23NO2/c1-11(12-6-8-14(18-3)9-7-12)16-15(10-17-2)13-4-5-13/h6-9,11,13,15-16H,4-5,10H2,1-3H3/t11-,15?/m1/s1
InChIKeyYJBRXZKFJONFSF-ZRKZCGFPSA-N
XLogP2.77
TPSA30.49 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 ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-[(1R)-1-(4-methoxyphenyl)ethyl]butan-1-amine
CID 114275947
1-(4-methoxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]ethanamine
CID 12644064
6-[1-[(1-cyclopropyl-2-methoxyethyl)amino]ethyl]-1,4-dihydroquinoxaline-2,3-dione
CID 154766334
1-cyclobutyl-N-[1-(4-methoxyphenyl)ethyl]ethanamine
CID 115714644
1-cyclopropyl-N-[1-(4-ethoxyphenyl)ethyl]propan-1-amine
CID 64918622
1-cyclobutyl-N-[(1R)-1-(4-methoxyphenyl)ethyl]propan-2-amine
CID 104866403
1-cyclopropyl-2-methoxy-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81402259
5-methoxy-4-N-[1-(4-methoxyphenyl)ethyl]pentane-1,4-diamine
CID 103390275
N-[(1R)-1-(4-methoxyphenyl)ethyl]-1-(1-methylpiperidin-4-yl)ethanamine
CID 81371064
N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(1H-pyrazol-4-yl)ethanamine
CID 106209383
(1S)-N-(cyclobutylmethyl)-1-(4-methoxyphenyl)ethanamine
CID 81371090
N-[cyclopropyl-(4-methoxyphenyl)methyl]butan-2-amine
CID 43756360

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine?
The IUPAC name of 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine (CID 81370901) is 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine is COCC(N[C@H](C)c1ccc(OC)cc1)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine?
The InChIKey is YJBRXZKFJONFSF-ZRKZCGFPSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11(12-6-8-14(18-3)9-7-12)16-15(10-17-2)13-4-5-13/h6-9,11,13,15-16H,4-5,10H2,1-3H3/t11-,15?/m1/s1.
What are the key properties of 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine?
1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine has a molecular weight of 249.35 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]ethanamine is sourced from PubChem (CID 81370901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).