(3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid

C10H18N2O3 — CID 735293

IUPAC(3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid
SMILESCN(C)CCCN1C[C@H](C(=O)O)CC1=O
InChIInChI=1S/C10H18N2O3/c1-11(2)4-3-5-12-7-8(10(14)15)6-9(12)13/h8H,3-7H2,1-2H3,(H,14,15)/t8-/m1/s1
InChIKeyMUPFIGLSLOVQLZ-MRVPVSSYSA-N
MW214.26 g/mol
LogP-0.13
Rot. Bonds5

About (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid

(3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid (PubChem CID 735293) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid
PubChem CID735293
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name(3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid
SMILESCN(C)CCCN1C[C@H](C(=O)O)CC1=O
InChIInChI=1S/C10H18N2O3/c1-11(2)4-3-5-12-7-8(10(14)15)6-9(12)13/h8H,3-7H2,1-2H3,(H,14,15)/t8-/m1/s1
InChIKeyMUPFIGLSLOVQLZ-MRVPVSSYSA-N
XLogP-0.13
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-hexyl-5-oxopyrrolidine-3-carboxylic acid
CID 7144531
1-decyl-5-oxopyrrolidine-3-carboxylic acid
CID 3023563
N-butyl-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxamide
CID 108787285
2-[[1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carbonyl]amino]butanoic acid
CID 108800194
1-[3-(dimethylamino)propyl]-N-(1-hydroxy-2-methylpropan-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 108800222
1-[1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carbonyl]piperidine-4-carboxamide
CID 108800270
(3R)-1-(3-aminopropyl)-5-oxopyrrolidine-3-carboxylic acid
CID 92755218
(3S)-5-oxo-1-propylpyrrolidine-3-carboxylic acid
CID 7583712
N-(4-anilinophenyl)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxamide
CID 108787376
N-benzyl-1-[3-(dimethylamino)propyl]-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 113183127
(3R)-1-butyl-N-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxamide
CID 9397964
1-[3-(dimethylamino)propyl]-N-(3,5-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 108800213

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid?
The IUPAC name of (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid (CID 735293) is (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid.
What is the SMILES notation for (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid?
The canonical SMILES for (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid is CN(C)CCCN1C[C@H](C(=O)O)CC1=O.
What is the InChIKey of (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid?
The InChIKey is MUPFIGLSLOVQLZ-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-11(2)4-3-5-12-7-8(10(14)15)6-9(12)13/h8H,3-7H2,1-2H3,(H,14,15)/t8-/m1/s1.
What are the key properties of (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid?
(3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid has a molecular weight of 214.26 g/mol, XLogP of -0.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid is sourced from PubChem (CID 735293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).