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

C13H24N2O3 — CID 107567557

IUPAC(2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid
SMILESCCCC1CCN(C(=O)N[C@H](CCC)C(=O)O)C1
InChIInChI=1S/C13H24N2O3/c1-3-5-10-7-8-15(9-10)13(18)14-11(6-4-2)12(16)17/h10-11H,3-9H2,1-2H3,(H,14,18)(H,16,17)/t10?,11-/m1/s1
InChIKeyBGGHZHZXPYLJBS-RRKGBCIJSA-N
MW256.35 g/mol
LogP2.07
Rot. Bonds6

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

(2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid (PubChem CID 107567557) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid.

Molecular Properties

Compound Name(2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid
PubChem CID107567557
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name(2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid
SMILESCCCC1CCN(C(=O)N[C@H](CCC)C(=O)O)C1
InChIInChI=1S/C13H24N2O3/c1-3-5-10-7-8-15(9-10)13(18)14-11(6-4-2)12(16)17/h10-11H,3-9H2,1-2H3,(H,14,18)(H,16,17)/t10?,11-/m1/s1
InChIKeyBGGHZHZXPYLJBS-RRKGBCIJSA-N
XLogP2.07
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-4-hydroxy-2-[(3-propylpyrrolidine-1-carbonyl)amino]butanoic acid
CID 107828904
(2R)-2-[(3-aminopyrrolidine-1-carbonyl)amino]pentanoic acid
CID 107566773
(2S)-4-hydroxy-2-[(4-propylpiperidine-1-carbonyl)amino]butanoic acid
CID 107827463
(2R)-2-[[4-(hydroxymethyl)piperidine-1-carbonyl]amino]pentanoic acid
CID 107566112
(2S,3R)-3-hydroxy-2-[(3-propylpyrrolidine-1-carbonyl)amino]butanoic acid
CID 104966563
(2S)-2-[[3-(1-hydroxyethyl)pyrrolidine-1-carbonyl]amino]pentanoic acid
CID 107567485
2-[(4-methoxycarbonylpiperidine-1-carbonyl)amino]pentanoic acid
CID 61193645
(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
(2S)-5-amino-2-[(3-ethylpyrrolidine-1-carbonyl)amino]-5-oxopentanoic acid
CID 113418287
(2S)-2-[(4-methylazepane-1-carbonyl)amino]pentanoic acid
CID 107566997

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid?
The IUPAC name of (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid (CID 107567557) is (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid.
What is the SMILES notation for (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid?
The canonical SMILES for (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid is CCCC1CCN(C(=O)N[C@H](CCC)C(=O)O)C1.
What is the InChIKey of (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid?
The InChIKey is BGGHZHZXPYLJBS-RRKGBCIJSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-3-5-10-7-8-15(9-10)13(18)14-11(6-4-2)12(16)17/h10-11H,3-9H2,1-2H3,(H,14,18)(H,16,17)/t10?,11-/m1/s1.
What are the key properties of (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid?
(2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid has a molecular weight of 256.35 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(3-propylpyrrolidine-1-carbonyl)amino]pentanoic acid is sourced from PubChem (CID 107567557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).