(R)-cyclopropyl-(2,3-dimethylphenyl)methanamine

C12H17N — CID 55278882

IUPAC(R)-cyclopropyl-(2,3-dimethylphenyl)methanamine
SMILESCc1cccc([C@H](N)C2CC2)c1C
InChIInChI=1S/C12H17N/c1-8-4-3-5-11(9(8)2)12(13)10-6-7-10/h3-5,10,12H,6-7,13H2,1-2H3/t12-/m1/s1
InChIKeyQCHRBDNKQOSQQJ-GFCCVEGCSA-N
MW175.27 g/mol
LogP2.71
Rot. Bonds2

About (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine

(R)-cyclopropyl-(2,3-dimethylphenyl)methanamine (PubChem CID 55278882) has the molecular formula C12H17N and a molecular weight of 175.27 g/mol. Its IUPAC name is (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine.

Molecular Properties

Compound Name(R)-cyclopropyl-(2,3-dimethylphenyl)methanamine
PubChem CID55278882
Molecular FormulaC12H17N
Molecular Weight175.27 g/mol
Exact Mass175.14
IUPAC Name(R)-cyclopropyl-(2,3-dimethylphenyl)methanamine
SMILESCc1cccc([C@H](N)C2CC2)c1C
InChIInChI=1S/C12H17N/c1-8-4-3-5-11(9(8)2)12(13)10-6-7-10/h3-5,10,12H,6-7,13H2,1-2H3/t12-/m1/s1
InChIKeyQCHRBDNKQOSQQJ-GFCCVEGCSA-N
XLogP2.71
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine?
The IUPAC name of (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine (CID 55278882) is (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine.
What is the SMILES notation for (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine?
The canonical SMILES for (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine is Cc1cccc([C@H](N)C2CC2)c1C.
What is the InChIKey of (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine?
The InChIKey is QCHRBDNKQOSQQJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H17N/c1-8-4-3-5-11(9(8)2)12(13)10-6-7-10/h3-5,10,12H,6-7,13H2,1-2H3/t12-/m1/s1.
What are the key properties of (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine?
(R)-cyclopropyl-(2,3-dimethylphenyl)methanamine has a molecular weight of 175.27 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cyclopropyl-(2,3-dimethylphenyl)methanamine is sourced from PubChem (CID 55278882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).