[2-(cyclopropylmethoxy)phenyl]methanamine

C11H15NO — CID 19627413

IUPAC[2-(cyclopropylmethoxy)phenyl]methanamine
SMILESNCc1ccccc1OCC1CC1
InChIInChI=1S/C11H15NO/c12-7-10-3-1-2-4-11(10)13-8-9-5-6-9/h1-4,9H,5-8,12H2
InChIKeyLACVTFBJIFJJFZ-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.93
Rot. Bonds4

About [2-(cyclopropylmethoxy)phenyl]methanamine

[2-(cyclopropylmethoxy)phenyl]methanamine (PubChem CID 19627413) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is [2-(cyclopropylmethoxy)phenyl]methanamine.

Molecular Properties

Compound Name[2-(cyclopropylmethoxy)phenyl]methanamine
PubChem CID19627413
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name[2-(cyclopropylmethoxy)phenyl]methanamine
SMILESNCc1ccccc1OCC1CC1
InChIInChI=1S/C11H15NO/c12-7-10-3-1-2-4-11(10)13-8-9-5-6-9/h1-4,9H,5-8,12H2
InChIKeyLACVTFBJIFJJFZ-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(cyclopropylmethoxy)phenyl]methanamine?
The IUPAC name of [2-(cyclopropylmethoxy)phenyl]methanamine (CID 19627413) is [2-(cyclopropylmethoxy)phenyl]methanamine.
What is the SMILES notation for [2-(cyclopropylmethoxy)phenyl]methanamine?
The canonical SMILES for [2-(cyclopropylmethoxy)phenyl]methanamine is NCc1ccccc1OCC1CC1.
What is the InChIKey of [2-(cyclopropylmethoxy)phenyl]methanamine?
The InChIKey is LACVTFBJIFJJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c12-7-10-3-1-2-4-11(10)13-8-9-5-6-9/h1-4,9H,5-8,12H2.
What are the key properties of [2-(cyclopropylmethoxy)phenyl]methanamine?
[2-(cyclopropylmethoxy)phenyl]methanamine has a molecular weight of 177.25 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopropylmethoxy)phenyl]methanamine is sourced from PubChem (CID 19627413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).