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

C10H13NO — CID 12523671

IUPAC1-(4-methoxyphenyl)cyclopropan-1-amine
SMILESCOc1ccc(C2(N)CC2)cc1
InChIInChI=1S/C10H13NO/c1-12-9-4-2-8(3-5-9)10(11)6-7-10/h2-5H,6-7,11H2,1H3
InChIKeyANCAJMAPVNINSB-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.64
Rot. Bonds2

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

1-(4-methoxyphenyl)cyclopropan-1-amine (PubChem CID 12523671) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)cyclopropan-1-amine
PubChem CID12523671
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name1-(4-methoxyphenyl)cyclopropan-1-amine
SMILESCOc1ccc(C2(N)CC2)cc1
InChIInChI=1S/C10H13NO/c1-12-9-4-2-8(3-5-9)10(11)6-7-10/h2-5H,6-7,11H2,1H3
InChIKeyANCAJMAPVNINSB-UHFFFAOYSA-N
XLogP1.64
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 ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 31721
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CID 4657
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CID 793467
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CID 736827
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CID 152234
CID 152234
CID 3082143
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CID 56263
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CID 36133779
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CID 238181
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CID 6951129
CID 6951129
CID 59831
CID 59831

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)cyclopropan-1-amine?
The IUPAC name of 1-(4-methoxyphenyl)cyclopropan-1-amine (CID 12523671) is 1-(4-methoxyphenyl)cyclopropan-1-amine.
What is the SMILES notation for 1-(4-methoxyphenyl)cyclopropan-1-amine?
The canonical SMILES for 1-(4-methoxyphenyl)cyclopropan-1-amine is COc1ccc(C2(N)CC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)cyclopropan-1-amine?
The InChIKey is ANCAJMAPVNINSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-12-9-4-2-8(3-5-9)10(11)6-7-10/h2-5H,6-7,11H2,1H3.
What are the key properties of 1-(4-methoxyphenyl)cyclopropan-1-amine?
1-(4-methoxyphenyl)cyclopropan-1-amine has a molecular weight of 163.22 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)cyclopropan-1-amine is sourced from PubChem (CID 12523671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).