N,3-diphenylpyrrolidine-1-carboxamide

C17H18N2O — CID 3244652

IUPACN,3-diphenylpyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC(c2ccccc2)C1
InChIInChI=1S/C17H18N2O/c20-17(18-16-9-5-2-6-10-16)19-12-11-15(13-19)14-7-3-1-4-8-14/h1-10,15H,11-13H2,(H,18,20)
InChIKeyMZAQOOWXHQBKBK-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.71
Rot. Bonds2

About N,3-diphenylpyrrolidine-1-carboxamide

N,3-diphenylpyrrolidine-1-carboxamide (PubChem CID 3244652) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is N,3-diphenylpyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN,3-diphenylpyrrolidine-1-carboxamide
PubChem CID3244652
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC NameN,3-diphenylpyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC(c2ccccc2)C1
InChIInChI=1S/C17H18N2O/c20-17(18-16-9-5-2-6-10-16)19-12-11-15(13-19)14-7-3-1-4-8-14/h1-10,15H,11-13H2,(H,18,20)
InChIKeyMZAQOOWXHQBKBK-UHFFFAOYSA-N
XLogP3.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,3-diphenylpyrrolidine-1-carboxamide?
The IUPAC name of N,3-diphenylpyrrolidine-1-carboxamide (CID 3244652) is N,3-diphenylpyrrolidine-1-carboxamide.
What is the SMILES notation for N,3-diphenylpyrrolidine-1-carboxamide?
The canonical SMILES for N,3-diphenylpyrrolidine-1-carboxamide is O=C(Nc1ccccc1)N1CCC(c2ccccc2)C1.
What is the InChIKey of N,3-diphenylpyrrolidine-1-carboxamide?
The InChIKey is MZAQOOWXHQBKBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c20-17(18-16-9-5-2-6-10-16)19-12-11-15(13-19)14-7-3-1-4-8-14/h1-10,15H,11-13H2,(H,18,20).
What are the key properties of N,3-diphenylpyrrolidine-1-carboxamide?
N,3-diphenylpyrrolidine-1-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-diphenylpyrrolidine-1-carboxamide is sourced from PubChem (CID 3244652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).