1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid

C10H18N2O3 — CID 103848580

IUPAC1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid
SMILESCCC[C@@H](N)C(=O)N1CCC(C(=O)O)C1
InChIInChI=1S/C10H18N2O3/c1-2-3-8(11)9(13)12-5-4-7(6-12)10(14)15/h7-8H,2-6,11H2,1H3,(H,14,15)/t7?,8-/m1/s1
InChIKeyQQMRBYGOBTYWMN-BRFYHDHCSA-N
MW214.26 g/mol
LogP0.05
Rot. Bonds4

About 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid

1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid (PubChem CID 103848580) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid
PubChem CID103848580
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid
SMILESCCC[C@@H](N)C(=O)N1CCC(C(=O)O)C1
InChIInChI=1S/C10H18N2O3/c1-2-3-8(11)9(13)12-5-4-7(6-12)10(14)15/h7-8H,2-6,11H2,1H3,(H,14,15)/t7?,8-/m1/s1
InChIKeyQQMRBYGOBTYWMN-BRFYHDHCSA-N
XLogP0.05
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2R)-2-aminopentanoyl]-3-methylpiperidine-4-carboxylic acid
CID 114278530
2-amino-1-[3-(hydroxymethyl)pyrrolidin-1-yl]pentan-1-one
CID 112624987
2-amino-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-1-one
CID 63167118
2-amino-1-(azocan-1-yl)pentan-1-one;hydrochloride
CID 119264220
3-[1-[(2S)-2-aminopentanoyl]pyrrolidin-3-yl]propanoic acid
CID 103870649
4-[(2S)-2-aminopentanoyl]morpholine-2-carboxylic acid
CID 107569483
1-(2-amino-3-carboxypropanoyl)piperidine-3-carboxylic acid
CID 64897100
2-amino-1-(4-hydroxy-3-methylpiperidin-1-yl)pentan-1-one
CID 114678311
1-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-2-aminopentan-1-one
CID 43650387
1-[(2R)-2-aminopentanoyl]-N-methylpiperidine-3-carboxamide
CID 103796757
2-amino-1-(3-methylpiperidin-1-yl)pentan-1-one
CID 43649995
(2S)-2-amino-1-[4-(dimethylamino)piperidin-1-yl]pentan-1-one
CID 93255628

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid?
The IUPAC name of 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid (CID 103848580) is 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid.
What is the SMILES notation for 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid?
The canonical SMILES for 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid is CCC[C@@H](N)C(=O)N1CCC(C(=O)O)C1.
What is the InChIKey of 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid?
The InChIKey is QQMRBYGOBTYWMN-BRFYHDHCSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-2-3-8(11)9(13)12-5-4-7(6-12)10(14)15/h7-8H,2-6,11H2,1H3,(H,14,15)/t7?,8-/m1/s1.
What are the key properties of 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid?
1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid has a molecular weight of 214.26 g/mol, XLogP of 0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-aminopentanoyl]pyrrolidine-3-carboxylic acid is sourced from PubChem (CID 103848580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).