(2-propan-2-yloxyphenyl)methanamine

C10H15NO — CID 735893

IUPAC(2-propan-2-yloxyphenyl)methanamine
SMILESCC(C)Oc1ccccc1CN
InChIInChI=1S/C10H15NO/c1-8(2)12-10-6-4-3-5-9(10)7-11/h3-6,8H,7,11H2,1-2H3
InChIKeyRJWAKPHKRZMFHG-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.93
Rot. Bonds3

About (2-propan-2-yloxyphenyl)methanamine

(2-propan-2-yloxyphenyl)methanamine (PubChem CID 735893) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (2-propan-2-yloxyphenyl)methanamine.

Molecular Properties

Compound Name(2-propan-2-yloxyphenyl)methanamine
PubChem CID735893
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(2-propan-2-yloxyphenyl)methanamine
SMILESCC(C)Oc1ccccc1CN
InChIInChI=1S/C10H15NO/c1-8(2)12-10-6-4-3-5-9(10)7-11/h3-6,8H,7,11H2,1-2H3
InChIKeyRJWAKPHKRZMFHG-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
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-propan-2-yloxyphenyl)methanamine?
The IUPAC name of (2-propan-2-yloxyphenyl)methanamine (CID 735893) is (2-propan-2-yloxyphenyl)methanamine.
What is the SMILES notation for (2-propan-2-yloxyphenyl)methanamine?
The canonical SMILES for (2-propan-2-yloxyphenyl)methanamine is CC(C)Oc1ccccc1CN.
What is the InChIKey of (2-propan-2-yloxyphenyl)methanamine?
The InChIKey is RJWAKPHKRZMFHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-8(2)12-10-6-4-3-5-9(10)7-11/h3-6,8H,7,11H2,1-2H3.
What are the key properties of (2-propan-2-yloxyphenyl)methanamine?
(2-propan-2-yloxyphenyl)methanamine has a molecular weight of 165.24 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propan-2-yloxyphenyl)methanamine is sourced from PubChem (CID 735893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).