1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine

C20H23N — CID 173232892

IUPAC1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine
SMILESc1ccc(CC2(c3ccccc3)CC2N2CCCC2)cc1
InChIInChI=1S/C20H23N/c1-3-9-17(10-4-1)15-20(18-11-5-2-6-12-18)16-19(20)21-13-7-8-14-21/h1-6,9-12,19H,7-8,13-16H2
InChIKeyZPRXIADNVPYJHY-UHFFFAOYSA-N
MW277.41 g/mol
LogP4.04
Rot. Bonds4

About 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine

1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine (PubChem CID 173232892) has the molecular formula C20H23N and a molecular weight of 277.41 g/mol. Its IUPAC name is 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine.

Molecular Properties

Compound Name1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine
PubChem CID173232892
Molecular FormulaC20H23N
Molecular Weight277.41 g/mol
Exact Mass277.18
IUPAC Name1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine
SMILESc1ccc(CC2(c3ccccc3)CC2N2CCCC2)cc1
InChIInChI=1S/C20H23N/c1-3-9-17(10-4-1)15-20(18-11-5-2-6-12-18)16-19(20)21-13-7-8-14-21/h1-6,9-12,19H,7-8,13-16H2
InChIKeyZPRXIADNVPYJHY-UHFFFAOYSA-N
XLogP4.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine?
The IUPAC name of 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine (CID 173232892) is 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine.
What is the SMILES notation for 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine?
The canonical SMILES for 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine is c1ccc(CC2(c3ccccc3)CC2N2CCCC2)cc1.
What is the InChIKey of 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine?
The InChIKey is ZPRXIADNVPYJHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N/c1-3-9-17(10-4-1)15-20(18-11-5-2-6-12-18)16-19(20)21-13-7-8-14-21/h1-6,9-12,19H,7-8,13-16H2.
What are the key properties of 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine?
1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine has a molecular weight of 277.41 g/mol, XLogP of 4.04, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-benzyl-2-phenylcyclopropyl)pyrrolidine is sourced from PubChem (CID 173232892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).