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

C10H13NO — CID 3082143

IUPAC2-(4-methoxyphenyl)cyclopropan-1-amine
SMILESCOc1ccc(C2CC2N)cc1
InChIInChI=1S/C10H13NO/c1-12-8-4-2-7(3-5-8)9-6-10(9)11/h2-5,9-10H,6,11H2,1H3
InChIKeySCLDJNREJBDLHE-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.51
Rot. Bonds2

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

2-(4-methoxyphenyl)cyclopropan-1-amine (PubChem CID 3082143) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)cyclopropan-1-amine.

Molecular Properties

Compound Name2-(4-methoxyphenyl)cyclopropan-1-amine
PubChem CID3082143
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name2-(4-methoxyphenyl)cyclopropan-1-amine
SMILESCOc1ccc(C2CC2N)cc1
InChIInChI=1S/C10H13NO/c1-12-8-4-2-7(3-5-8)9-6-10(9)11/h2-5,9-10H,6,11H2,1H3
InChIKeySCLDJNREJBDLHE-UHFFFAOYSA-N
XLogP1.51
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)cyclopropan-1-amine?
The IUPAC name of 2-(4-methoxyphenyl)cyclopropan-1-amine (CID 3082143) is 2-(4-methoxyphenyl)cyclopropan-1-amine.
What is the SMILES notation for 2-(4-methoxyphenyl)cyclopropan-1-amine?
The canonical SMILES for 2-(4-methoxyphenyl)cyclopropan-1-amine is COc1ccc(C2CC2N)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)cyclopropan-1-amine?
The InChIKey is SCLDJNREJBDLHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-12-8-4-2-7(3-5-8)9-6-10(9)11/h2-5,9-10H,6,11H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)cyclopropan-1-amine?
2-(4-methoxyphenyl)cyclopropan-1-amine has a molecular weight of 163.22 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)cyclopropan-1-amine is sourced from PubChem (CID 3082143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).