(2-cyclopropyl-5-methylphenyl)methanamine

C11H15N — CID 90236498

IUPAC(2-cyclopropyl-5-methylphenyl)methanamine
SMILESCc1ccc(C2CC2)c(CN)c1
InChIInChI=1S/C11H15N/c1-8-2-5-11(9-3-4-9)10(6-8)7-12/h2,5-6,9H,3-4,7,12H2,1H3
InChIKeyPRQJMDBZCYJGPH-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.33
Rot. Bonds2

About (2-cyclopropyl-5-methylphenyl)methanamine

(2-cyclopropyl-5-methylphenyl)methanamine (PubChem CID 90236498) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is (2-cyclopropyl-5-methylphenyl)methanamine.

Molecular Properties

Compound Name(2-cyclopropyl-5-methylphenyl)methanamine
PubChem CID90236498
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name(2-cyclopropyl-5-methylphenyl)methanamine
SMILESCc1ccc(C2CC2)c(CN)c1
InChIInChI=1S/C11H15N/c1-8-2-5-11(9-3-4-9)10(6-8)7-12/h2,5-6,9H,3-4,7,12H2,1H3
InChIKeyPRQJMDBZCYJGPH-UHFFFAOYSA-N
XLogP2.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2-cyclopropyl-5-methylphenyl)methanamine?
The IUPAC name of (2-cyclopropyl-5-methylphenyl)methanamine (CID 90236498) is (2-cyclopropyl-5-methylphenyl)methanamine.
What is the SMILES notation for (2-cyclopropyl-5-methylphenyl)methanamine?
The canonical SMILES for (2-cyclopropyl-5-methylphenyl)methanamine is Cc1ccc(C2CC2)c(CN)c1.
What is the InChIKey of (2-cyclopropyl-5-methylphenyl)methanamine?
The InChIKey is PRQJMDBZCYJGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-8-2-5-11(9-3-4-9)10(6-8)7-12/h2,5-6,9H,3-4,7,12H2,1H3.
What are the key properties of (2-cyclopropyl-5-methylphenyl)methanamine?
(2-cyclopropyl-5-methylphenyl)methanamine has a molecular weight of 161.25 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropyl-5-methylphenyl)methanamine is sourced from PubChem (CID 90236498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).