(2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid

C12H20N2O3 — CID 104863962

IUPAC(2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid
SMILESCC(CNC(=O)N1CCC[C@@H]1C(=O)O)C1CC1
InChIInChI=1S/C12H20N2O3/c1-8(9-4-5-9)7-13-12(17)14-6-2-3-10(14)11(15)16/h8-10H,2-7H2,1H3,(H,13,17)(H,15,16)/t8?,10-/m1/s1
InChIKeyVEGVYWLSLNBSGA-LHIURRSHSA-N
MW240.30 g/mol
LogP1.29
Rot. Bonds4

About (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid

(2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid (PubChem CID 104863962) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid
PubChem CID104863962
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name(2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid
SMILESCC(CNC(=O)N1CCC[C@@H]1C(=O)O)C1CC1
InChIInChI=1S/C12H20N2O3/c1-8(9-4-5-9)7-13-12(17)14-6-2-3-10(14)11(15)16/h8-10H,2-7H2,1H3,(H,13,17)(H,15,16)/t8?,10-/m1/s1
InChIKeyVEGVYWLSLNBSGA-LHIURRSHSA-N
XLogP1.29
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-[(2-methyl-3-methylsulfanylpropyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 78955144
(2S)-1-(3-methylbutylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 28510076
1-(2-cyclopropylpropylcarbamoyl)-2-methylpiperidine-4-carboxylic acid
CID 106744532
1-(prop-2-ynylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 61192237
1-(1-cyclopropylpropan-2-ylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 63996144
(2S)-1-(ethylcarbamoyl)piperidine-2-carboxylic acid
CID 66264798
3-[(2-carbamoylpyrrolidine-1-carbonyl)amino]-2-methylpropanoic acid
CID 62670104
1-(2-propan-2-yloxyethylcarbamoyl)azepane-2-carboxylic acid
CID 113450642
1-(5-methylhexan-2-ylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 63925924
(2R)-1-[[2-(ethylamino)-2-oxoethyl]carbamoyl]pyrrolidine-2-carboxylic acid
CID 55151526
(2S)-1-(4-methylpentan-2-ylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 61197461
1-[(2,2,3,3-tetramethylcyclopropyl)methylcarbamoyl]pyrrolidine-2-carboxylic acid
CID 79350073

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid?
The IUPAC name of (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid (CID 104863962) is (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid?
The canonical SMILES for (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid is CC(CNC(=O)N1CCC[C@@H]1C(=O)O)C1CC1.
What is the InChIKey of (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid?
The InChIKey is VEGVYWLSLNBSGA-LHIURRSHSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-8(9-4-5-9)7-13-12(17)14-6-2-3-10(14)11(15)16/h8-10H,2-7H2,1H3,(H,13,17)(H,15,16)/t8?,10-/m1/s1.
What are the key properties of (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid?
(2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid has a molecular weight of 240.30 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2-cyclopropylpropylcarbamoyl)pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 104863962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).