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

C14H21NO — CID 81397213

IUPAC1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine
SMILESCOc1ccccc1[C@@H](C)NC(C)C1CC1
InChIInChI=1S/C14H21NO/c1-10(12-8-9-12)15-11(2)13-6-4-5-7-14(13)16-3/h4-7,10-12,15H,8-9H2,1-3H3/t10?,11-/m1/s1
InChIKeyTVEBMEUEYFVOEQ-RRKGBCIJSA-N
MW219.33 g/mol
LogP3.14
Rot. Bonds5

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

1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine (PubChem CID 81397213) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine
PubChem CID81397213
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine
SMILESCOc1ccccc1[C@@H](C)NC(C)C1CC1
InChIInChI=1S/C14H21NO/c1-10(12-8-9-12)15-11(2)13-6-4-5-7-14(13)16-3/h4-7,10-12,15H,8-9H2,1-3H3/t10?,11-/m1/s1
InChIKeyTVEBMEUEYFVOEQ-RRKGBCIJSA-N
XLogP3.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-(2-methoxyphenyl)-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine
CID 11346678
(1S)-1-cyclohexyl-N-[1-[2-(difluoromethoxy)phenyl]ethyl]ethanamine
CID 81390973
N-[(1S)-1-(2-bromophenyl)ethyl]-1-cyclopropylethanamine
CID 81383862
(1R)-N-[1-(2-methoxyphenyl)ethyl]-1-(2-methylphenyl)ethanamine
CID 81373592
1-cyclopentyl-N-[1-(2,5-dimethoxyphenyl)ethyl]ethanamine
CID 62632992
N-[(1S)-1-cyclohexylethyl]-1-(2-methoxyphenyl)propan-1-amine
CID 81387812
1-cyclopropyl-2-(2-methoxyphenyl)ethane-1,2-diol
CID 103456830
(1R)-N-[(1R)-1-(2-methoxyphenyl)ethyl]-1-phenylethanamine
CID 13234523
(1S)-1-cycloheptyl-N-[1-(2-methylphenyl)ethyl]ethanamine
CID 81390722
N-[1-(2-methoxy-5-methylphenyl)ethyl]-1-(1-methylpiperidin-4-yl)ethanamine
CID 43685208
(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine
CID 81395665
(1R)-1-(2-methoxyphenyl)-N-[1-(1-methylcyclopropyl)ethyl]ethanamine
CID 81397646

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine?
The IUPAC name of 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine (CID 81397213) is 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine is COc1ccccc1[C@@H](C)NC(C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine?
The InChIKey is TVEBMEUEYFVOEQ-RRKGBCIJSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(12-8-9-12)15-11(2)13-6-4-5-7-14(13)16-3/h4-7,10-12,15H,8-9H2,1-3H3/t10?,11-/m1/s1.
What are the key properties of 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine?
1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine has a molecular weight of 219.33 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine is sourced from PubChem (CID 81397213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).