(1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine

C14H19N — CID 105453912

IUPAC(1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine
SMILESCc1cccc(C2(C3CCC3)C[C@H]2N)c1
InChIInChI=1S/C14H19N/c1-10-4-2-7-12(8-10)14(9-13(14)15)11-5-3-6-11/h2,4,7-8,11,13H,3,5-6,9,15H2,1H3/t13-,14?/m1/s1
InChIKeyCZVZEBGICBDVIM-KWCCSABGSA-N
MW201.31 g/mol
LogP2.76
Rot. Bonds2

About (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine

(1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine (PubChem CID 105453912) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine.

Molecular Properties

Compound Name(1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine
PubChem CID105453912
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name(1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine
SMILESCc1cccc(C2(C3CCC3)C[C@H]2N)c1
InChIInChI=1S/C14H19N/c1-10-4-2-7-12(8-10)14(9-13(14)15)11-5-3-6-11/h2,4,7-8,11,13H,3,5-6,9,15H2,1H3/t13-,14?/m1/s1
InChIKeyCZVZEBGICBDVIM-KWCCSABGSA-N
XLogP2.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine?
The IUPAC name of (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine (CID 105453912) is (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine.
What is the SMILES notation for (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine?
The canonical SMILES for (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine is Cc1cccc(C2(C3CCC3)C[C@H]2N)c1.
What is the InChIKey of (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine?
The InChIKey is CZVZEBGICBDVIM-KWCCSABGSA-N. The full InChI is InChI=1S/C14H19N/c1-10-4-2-7-12(8-10)14(9-13(14)15)11-5-3-6-11/h2,4,7-8,11,13H,3,5-6,9,15H2,1H3/t13-,14?/m1/s1.
What are the key properties of (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine?
(1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine has a molecular weight of 201.31 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-cyclobutyl-2-(3-methylphenyl)cyclopropan-1-amine is sourced from PubChem (CID 105453912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).