[(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine

C18H21N — CID 178195046

IUPAC[(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine
SMILESCC1(C)[C@H](CN)[C@H]1c1ccccc1-c1ccccc1
InChIInChI=1S/C18H21N/c1-18(2)16(12-19)17(18)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-11,16-17H,12,19H2,1-2H3/t16-,17-/m1/s1
InChIKeySWHZTRAWMGVIFR-IAGOWNOFSA-N
MW251.37 g/mol
LogP4.05
Rot. Bonds3

About [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine

[(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine (PubChem CID 178195046) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine
PubChem CID178195046
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name[(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine
SMILESCC1(C)[C@H](CN)[C@H]1c1ccccc1-c1ccccc1
InChIInChI=1S/C18H21N/c1-18(2)16(12-19)17(18)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-11,16-17H,12,19H2,1-2H3/t16-,17-/m1/s1
InChIKeySWHZTRAWMGVIFR-IAGOWNOFSA-N
XLogP4.05
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine?
The IUPAC name of [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine (CID 178195046) is [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine.
What is the SMILES notation for [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine?
The canonical SMILES for [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine is CC1(C)[C@H](CN)[C@H]1c1ccccc1-c1ccccc1.
What is the InChIKey of [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine?
The InChIKey is SWHZTRAWMGVIFR-IAGOWNOFSA-N. The full InChI is InChI=1S/C18H21N/c1-18(2)16(12-19)17(18)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-11,16-17H,12,19H2,1-2H3/t16-,17-/m1/s1.
What are the key properties of [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine?
[(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine has a molecular weight of 251.37 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,3R)-2,2-dimethyl-3-(2-phenylphenyl)cyclopropyl]methanamine is sourced from PubChem (CID 178195046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).