2-phenyl-1,5-di(propan-2-yl)pyrrolidine

C16H25N — CID 21303250

IUPAC2-phenyl-1,5-di(propan-2-yl)pyrrolidine
SMILESCC(C)C1CCC(c2ccccc2)N1C(C)C
InChIInChI=1S/C16H25N/c1-12(2)15-10-11-16(17(15)13(3)4)14-8-6-5-7-9-14/h5-9,12-13,15-16H,10-11H2,1-4H3
InChIKeySGZHHFLXZPDHEX-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.26
Rot. Bonds3

About 2-phenyl-1,5-di(propan-2-yl)pyrrolidine

2-phenyl-1,5-di(propan-2-yl)pyrrolidine (PubChem CID 21303250) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 2-phenyl-1,5-di(propan-2-yl)pyrrolidine.

Molecular Properties

Compound Name2-phenyl-1,5-di(propan-2-yl)pyrrolidine
PubChem CID21303250
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name2-phenyl-1,5-di(propan-2-yl)pyrrolidine
SMILESCC(C)C1CCC(c2ccccc2)N1C(C)C
InChIInChI=1S/C16H25N/c1-12(2)15-10-11-16(17(15)13(3)4)14-8-6-5-7-9-14/h5-9,12-13,15-16H,10-11H2,1-4H3
InChIKeySGZHHFLXZPDHEX-UHFFFAOYSA-N
XLogP4.26
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[1-(2,5-diphenylpyrrolidin-1-yl)ethyl]-2,5-diphenylpyrrolidine
CID 89471638
(4S,6S,8aS)-4-phenyl-6-propan-2-yl-3,4,6,7,8,8a-hexahydropyrrolo[2,1-c][1,4]oxazin-1-one
CID 25179616
(2S,4R)-2-methyl-4-phenyl-3-propan-2-yl-1,3-oxazolidine
CID 102061324
(2S)-2-phenyl-1-propan-2-ylpiperidine
CID 140931618
1-methyl-4-phenyl-2-propan-2-ylpyrrolidine
CID 158471478
2-phenyl-1,4-di(propan-2-yl)pyrrolidine
CID 58778539
(2S)-2-[(2R,5S)-2,5-diphenylpyrrolidin-1-yl]-2-phenylethanol
CID 11089186
3-phenyl-1-propan-2-ylazetidine
CID 23628
1-methylsulfonyl-2-phenyl-5-propan-2-ylpiperidine
CID 169211755
(2R,5R)-1-[2-[(2R,5R)-2,5-diphenylpyrrolidin-1-yl]ethyl]-2,5-diphenylpyrrolidine
CID 135084679
1-methyl-2-phenylazetidine
CID 576373
2-phenyl-1-propan-2-yl-2,3-dihydroindole
CID 139389323

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1,5-di(propan-2-yl)pyrrolidine?
The IUPAC name of 2-phenyl-1,5-di(propan-2-yl)pyrrolidine (CID 21303250) is 2-phenyl-1,5-di(propan-2-yl)pyrrolidine.
What is the SMILES notation for 2-phenyl-1,5-di(propan-2-yl)pyrrolidine?
The canonical SMILES for 2-phenyl-1,5-di(propan-2-yl)pyrrolidine is CC(C)C1CCC(c2ccccc2)N1C(C)C.
What is the InChIKey of 2-phenyl-1,5-di(propan-2-yl)pyrrolidine?
The InChIKey is SGZHHFLXZPDHEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-12(2)15-10-11-16(17(15)13(3)4)14-8-6-5-7-9-14/h5-9,12-13,15-16H,10-11H2,1-4H3.
What are the key properties of 2-phenyl-1,5-di(propan-2-yl)pyrrolidine?
2-phenyl-1,5-di(propan-2-yl)pyrrolidine has a molecular weight of 231.38 g/mol, XLogP of 4.26, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1,5-di(propan-2-yl)pyrrolidine is sourced from PubChem (CID 21303250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).