2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide

C23H30N2O — CID 59347917

IUPAC2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide
SMILESCc1ccc(C(=O)NC(c2ccccc2)C(C)(C)N2CCCC2)c(C)c1
InChIInChI=1S/C23H30N2O/c1-17-12-13-20(18(2)16-17)22(26)24-21(19-10-6-5-7-11-19)23(3,4)25-14-8-9-15-25/h5-7,10-13,16,21H,8-9,14-15H2,1-4H3,(H,24,26)
InChIKeyFGNTXCJEQCBWDW-UHFFFAOYSA-N
MW350.51 g/mol
LogP4.65
Rot. Bonds5

About 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide

2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide (PubChem CID 59347917) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide
PubChem CID59347917
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC Name2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide
SMILESCc1ccc(C(=O)NC(c2ccccc2)C(C)(C)N2CCCC2)c(C)c1
InChIInChI=1S/C23H30N2O/c1-17-12-13-20(18(2)16-17)22(26)24-21(19-10-6-5-7-11-19)23(3,4)25-14-8-9-15-25/h5-7,10-13,16,21H,8-9,14-15H2,1-4H3,(H,24,26)
InChIKeyFGNTXCJEQCBWDW-UHFFFAOYSA-N
XLogP4.65
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide?
The IUPAC name of 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide (CID 59347917) is 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide.
What is the SMILES notation for 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide?
The canonical SMILES for 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide is Cc1ccc(C(=O)NC(c2ccccc2)C(C)(C)N2CCCC2)c(C)c1.
What is the InChIKey of 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide?
The InChIKey is FGNTXCJEQCBWDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O/c1-17-12-13-20(18(2)16-17)22(26)24-21(19-10-6-5-7-11-19)23(3,4)25-14-8-9-15-25/h5-7,10-13,16,21H,8-9,14-15H2,1-4H3,(H,24,26).
What are the key properties of 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide?
2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide has a molecular weight of 350.51 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(2-methyl-1-phenyl-2-pyrrolidin-1-ylpropyl)benzamide is sourced from PubChem (CID 59347917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).