3-(1-benzylcyclopropyl)pyrrolidine

C14H19N — CID 83908409

IUPAC3-(1-benzylcyclopropyl)pyrrolidine
SMILESc1ccc(CC2(C3CCNC3)CC2)cc1
InChIInChI=1S/C14H19N/c1-2-4-12(5-3-1)10-14(7-8-14)13-6-9-15-11-13/h1-5,13,15H,6-11H2
InChIKeyRBFWQLVBBJXMEV-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.62
Rot. Bonds3

About 3-(1-benzylcyclopropyl)pyrrolidine

3-(1-benzylcyclopropyl)pyrrolidine (PubChem CID 83908409) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 3-(1-benzylcyclopropyl)pyrrolidine.

Molecular Properties

Compound Name3-(1-benzylcyclopropyl)pyrrolidine
PubChem CID83908409
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name3-(1-benzylcyclopropyl)pyrrolidine
SMILESc1ccc(CC2(C3CCNC3)CC2)cc1
InChIInChI=1S/C14H19N/c1-2-4-12(5-3-1)10-14(7-8-14)13-6-9-15-11-13/h1-5,13,15H,6-11H2
InChIKeyRBFWQLVBBJXMEV-UHFFFAOYSA-N
XLogP2.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(1-benzylcyclobutyl)piperidine
CID 83911456
1-[(4-fluorophenyl)methyl]-3-azabicyclo[3.2.0]heptane
CID 84778581
2-benzyl-1,3-dimethyl-3-pyrrolidin-3-ylpyrrolidine
CID 177005554
4-(3-azabicyclo[3.2.0]heptan-1-ylmethyl)phenol
CID 84777454
(2R,3aR,7aS)-2-benzyl-2-methyl-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-c]pyridine
CID 175658095
4-phenyl-4-pyrrolidin-3-ylcyclohexan-1-one
CID 57475104
4-benzyl-3,4-diethylpiperidine
CID 79312303
6-benzyl-1,2,3,4,5,7,8,8a-octahydro-2,6-naphthyridin-4a-ol
CID 83669932
1-benzyl-N-methyl-N-pyrrolidin-3-ylcyclobutane-1-carboxamide;hydrochloride
CID 119554243
N-benzyl-N-methylpyrrolidin-3-amine
CID 14834678
(3R,4S)-4-benzylpiperidin-3-ol;hydrochloride
CID 171688498
4-benzyl-4-fluoropiperidine;ethane
CID 154662481

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzylcyclopropyl)pyrrolidine?
The IUPAC name of 3-(1-benzylcyclopropyl)pyrrolidine (CID 83908409) is 3-(1-benzylcyclopropyl)pyrrolidine.
What is the SMILES notation for 3-(1-benzylcyclopropyl)pyrrolidine?
The canonical SMILES for 3-(1-benzylcyclopropyl)pyrrolidine is c1ccc(CC2(C3CCNC3)CC2)cc1.
What is the InChIKey of 3-(1-benzylcyclopropyl)pyrrolidine?
The InChIKey is RBFWQLVBBJXMEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-2-4-12(5-3-1)10-14(7-8-14)13-6-9-15-11-13/h1-5,13,15H,6-11H2.
What are the key properties of 3-(1-benzylcyclopropyl)pyrrolidine?
3-(1-benzylcyclopropyl)pyrrolidine has a molecular weight of 201.31 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzylcyclopropyl)pyrrolidine is sourced from PubChem (CID 83908409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).