(2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid

C10H19N3O3 — CID 107566773

IUPAC(2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid
SMILESCCC[C@@H](NC(=O)N1CCC(N)C1)C(=O)O
InChIInChI=1S/C10H19N3O3/c1-2-3-8(9(14)15)12-10(16)13-5-4-7(11)6-13/h7-8H,2-6,11H2,1H3,(H,12,16)(H,14,15)/t7?,8-/m1/s1
InChIKeyIEYCTJRJHJPGGG-BRFYHDHCSA-N
MW229.28 g/mol
LogP-0.02
Rot. Bonds4

About (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid

(2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid (PubChem CID 107566773) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid.

Molecular Properties

Compound Name(2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid
PubChem CID107566773
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name(2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid
SMILESCCC[C@@H](NC(=O)N1CCC(N)C1)C(=O)O
InChIInChI=1S/C10H19N3O3/c1-2-3-8(9(14)15)12-10(16)13-5-4-7(11)6-13/h7-8H,2-6,11H2,1H3,(H,12,16)(H,14,15)/t7?,8-/m1/s1
InChIKeyIEYCTJRJHJPGGG-BRFYHDHCSA-N
XLogP-0.02
TPSA95.66 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid
CID 107567557
2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanedioic acid
CID 55029823
(2S)-2-[(4-aminopiperidine-1-carbonyl)amino]hexanoic acid
CID 107145596
(2R)-2-[[4-(hydroxymethyl)piperidine-1-carbonyl]amino]pentanoic acid
CID 107566112
(2S)-4-hydroxy-2-[(3-propylpyrrolidine-1-carbonyl)amino]butanoic acid
CID 107828904
(2S)-5-amino-2-[(3-ethylpyrrolidine-1-carbonyl)amino]-5-oxopentanoic acid
CID 113418287
(2S)-2-[[3-(1-hydroxyethyl)pyrrolidine-1-carbonyl]amino]pentanoic acid
CID 107567485
(2S)-2-[(3,4-dihydroxypyrrolidine-1-carbonyl)amino]pentanoic acid
CID 107567840
2-[[3-(methoxymethyl)pyrrolidine-1-carbonyl]amino]hexanoic acid
CID 64598838
(2R)-2-[[3-(methylaminomethyl)piperidine-1-carbonyl]amino]pentanoic acid
CID 107566360
(2R)-2-[(3-carbamoylpiperidine-1-carbonyl)amino]pentanoic acid
CID 107566036
(2S)-2-[(4-methylazepane-1-carbonyl)amino]pentanoic acid
CID 107566997

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid?
The IUPAC name of (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid (CID 107566773) is (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid.
What is the SMILES notation for (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid?
The canonical SMILES for (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid is CCC[C@@H](NC(=O)N1CCC(N)C1)C(=O)O.
What is the InChIKey of (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid?
The InChIKey is IEYCTJRJHJPGGG-BRFYHDHCSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-2-3-8(9(14)15)12-10(16)13-5-4-7(11)6-13/h7-8H,2-6,11H2,1H3,(H,12,16)(H,14,15)/t7?,8-/m1/s1.
What are the key properties of (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid?
(2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid has a molecular weight of 229.28 g/mol, XLogP of -0.02, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid is sourced from PubChem (CID 107566773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).