3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide

C19H28N4O2 — CID 128728484

IUPAC3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide
SMILESCN(C)C(=O)C1CCN(C(=O)NC2CCN(C)C2c2ccccc2)C1
InChIInChI=1S/C19H28N4O2/c1-21(2)18(24)15-9-12-23(13-15)19(25)20-16-10-11-22(3)17(16)14-7-5-4-6-8-14/h4-8,15-17H,9-13H2,1-3H3,(H,20,25)
InChIKeyQBVNXKKYRXCGPM-UHFFFAOYSA-N
MW344.46 g/mol
LogP1.55
Rot. Bonds3

About 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide

3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide (PubChem CID 128728484) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide
PubChem CID128728484
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC Name3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide
SMILESCN(C)C(=O)C1CCN(C(=O)NC2CCN(C)C2c2ccccc2)C1
InChIInChI=1S/C19H28N4O2/c1-21(2)18(24)15-9-12-23(13-15)19(25)20-16-10-11-22(3)17(16)14-7-5-4-6-8-14/h4-8,15-17H,9-13H2,1-3H3,(H,20,25)
InChIKeyQBVNXKKYRXCGPM-UHFFFAOYSA-N
XLogP1.55
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methyl-1-[(5-methylfuran-2-yl)methyl]-3-[(2R,3S)-1-methyl-2-phenylpyrrolidin-3-yl]urea
CID 124627279
1-[[2-(3,4-difluorophenyl)-1-methylpyrrolidin-3-yl]carbamoyl]-5-methylpiperidine-3-carboxylic acid
CID 122123325
1-(1,4-dimethyl-2-oxo-3-pyridinyl)-3-[(2S,3R)-1-methyl-2-phenylpyrrolidin-3-yl]urea
CID 124829856
1-(1,4-dimethyl-2-oxo-3-pyridinyl)-3-[(2R,3R)-1-methyl-2-phenylpyrrolidin-3-yl]urea
CID 99828887
(2S)-2-[[(2S,3R)-1-methyl-2-phenylpyrrolidin-3-yl]amino]-N-phenylpropanamide
CID 124863962
1-acetyl-N,N-dimethylpyrrolidine-3-carboxamide
CID 130660566
1-[(2R,3R)-1-methyl-2-phenylpyrrolidin-3-yl]-3-(2-methyl-4-pyridinyl)urea
CID 99828968
1-methyl-2-phenylpyrrolidine-3-carboxylic acid
CID 71778186
(2S,3R)-N-[(2S,3S)-1-methyl-2-phenylpyrrolidin-3-yl]-2-prop-1-en-2-yloxolane-3-carboxamide
CID 124737397
1-[[2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]carbamoyl]pyrrolidine-3-carboxylic acid
CID 122008577
1-[[(1R,2S)-2-phenylcyclopentyl]carbamoyl]piperidine-4-carboxylic acid
CID 122012024
1-[(2-phenylcyclopentyl)carbamoyl]piperidine-4-carboxylic acid
CID 122001822

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide?
The IUPAC name of 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide (CID 128728484) is 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide.
What is the SMILES notation for 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide?
The canonical SMILES for 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide is CN(C)C(=O)C1CCN(C(=O)NC2CCN(C)C2c2ccccc2)C1.
What is the InChIKey of 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide?
The InChIKey is QBVNXKKYRXCGPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-21(2)18(24)15-9-12-23(13-15)19(25)20-16-10-11-22(3)17(16)14-7-5-4-6-8-14/h4-8,15-17H,9-13H2,1-3H3,(H,20,25).
What are the key properties of 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide?
3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide has a molecular weight of 344.46 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-1-N-(1-methyl-2-phenylpyrrolidin-3-yl)pyrrolidine-1,3-dicarboxamide is sourced from PubChem (CID 128728484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).