(1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine

C12H17NO — CID 105445465

IUPAC(1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine
SMILESCCC1(c2ccc(OC)cc2)C[C@H]1N
InChIInChI=1S/C12H17NO/c1-3-12(8-11(12)13)9-4-6-10(14-2)7-5-9/h4-7,11H,3,8,13H2,1-2H3/t11-,12?/m1/s1
InChIKeyQIGUAVXRLWDFHY-JHJMLUEUSA-N
MW191.27 g/mol
LogP2.07
Rot. Bonds3

About (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine

(1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine (PubChem CID 105445465) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine.

Molecular Properties

Compound Name(1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine
PubChem CID105445465
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name(1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine
SMILESCCC1(c2ccc(OC)cc2)C[C@H]1N
InChIInChI=1S/C12H17NO/c1-3-12(8-11(12)13)9-4-6-10(14-2)7-5-9/h4-7,11H,3,8,13H2,1-2H3/t11-,12?/m1/s1
InChIKeyQIGUAVXRLWDFHY-JHJMLUEUSA-N
XLogP2.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-ethyl-2-(4-methoxyphenyl)cyclopropyl]methyl]-2-methylpropan-1-amine
CID 62714780
2-ethyl-1-(4-methoxyphenyl)cyclopropan-1-ol
CID 79332791
4-ethyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 114486964
[(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine
CID 105474852
3,3-diethyl-1-(4-methoxyphenyl)cyclobutan-1-amine
CID 65004013
2-ethyl-2-(4-methoxyphenyl)oxirane
CID 62772995
2-[(4-methoxyphenyl)methyl]-2-methylcyclopropan-1-amine;hydrochloride
CID 71756717
[2-(4-methoxyphenyl)-7-azabicyclo[2.2.1]heptan-2-yl]methanamine
CID 117194050
3-(4-methoxyphenyl)-3-methylcyclopentan-1-amine
CID 116538662
1-(4-methoxyphenyl)-3,5-dimethylcyclohexan-1-amine
CID 64751441
2-[(2R,4S,5S)-4-(4-methoxyphenyl)-1,2,5-trimethylpiperidin-4-yl]ethanamine
CID 7198410
methyl 3-amino-1-(4-methoxyphenyl)cyclobutane-1-carboxylate
CID 115040738

Frequently Asked Questions

What is the IUPAC name of (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine?
The IUPAC name of (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine (CID 105445465) is (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine.
What is the SMILES notation for (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine?
The canonical SMILES for (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine is CCC1(c2ccc(OC)cc2)C[C@H]1N.
What is the InChIKey of (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine?
The InChIKey is QIGUAVXRLWDFHY-JHJMLUEUSA-N. The full InChI is InChI=1S/C12H17NO/c1-3-12(8-11(12)13)9-4-6-10(14-2)7-5-9/h4-7,11H,3,8,13H2,1-2H3/t11-,12?/m1/s1.
What are the key properties of (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine?
(1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine has a molecular weight of 191.27 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine is sourced from PubChem (CID 105445465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).