(2R)-2-(2-aminopent-4-enoylamino)pentanoic acid

C10H18N2O3 — CID 107565006

IUPAC(2R)-2-(2-aminopent-4-enoylamino)pentanoic acid
SMILESC=CCC(N)C(=O)N[C@H](CCC)C(=O)O
InChIInChI=1S/C10H18N2O3/c1-3-5-7(11)9(13)12-8(6-4-2)10(14)15/h3,7-8H,1,4-6,11H2,2H3,(H,12,13)(H,14,15)/t7?,8-/m1/s1
InChIKeyLSGSTIVNKQEUCL-BRFYHDHCSA-N
MW214.26 g/mol
LogP0.26
Rot. Bonds7

About (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid

(2R)-2-(2-aminopent-4-enoylamino)pentanoic acid (PubChem CID 107565006) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid.

Molecular Properties

Compound Name(2R)-2-(2-aminopent-4-enoylamino)pentanoic acid
PubChem CID107565006
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name(2R)-2-(2-aminopent-4-enoylamino)pentanoic acid
SMILESC=CCC(N)C(=O)N[C@H](CCC)C(=O)O
InChIInChI=1S/C10H18N2O3/c1-3-5-7(11)9(13)12-8(6-4-2)10(14)15/h3,7-8H,1,4-6,11H2,2H3,(H,12,13)(H,14,15)/t7?,8-/m1/s1
InChIKeyLSGSTIVNKQEUCL-BRFYHDHCSA-N
XLogP0.26
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-[[(2S)-2-aminobutanoyl]amino]pentanoic acid
CID 103869979
2-[[(2R)-2-aminopentanoyl]amino]hexanoic acid
CID 103869500
2-[(2-amino-4-methylsulfonylbutanoyl)amino]pentanoic acid
CID 61161610
(2S)-2-[[(2R)-2-amino-4-methylsulfanylbutanoyl]amino]pentanoic acid
CID 107565129
2-amino-N-pent-4-en-2-ylpentanamide
CID 115734589
(2S)-2-[(4-amino-2-methylbutanoyl)amino]pentanoic acid
CID 107565180
(2S)-2-[[(2R)-2-methylhexanoyl]amino]pent-4-enoic acid
CID 87460969
(2S)-5-amino-2-[[(2R)-2-aminopentanoyl]amino]-5-oxopentanoic acid
CID 103870468
(2R)-5-amino-2-[[(2S)-2-aminopentanoyl]amino]-5-oxopentanoic acid
CID 107830315
2-(prop-2-enoylamino)pentanoic acid
CID 18798141
2-[[(2S)-2-aminoheptanoyl]amino]heptanoic acid
CID 121291203
(2R)-2-[[(2S)-2-aminopentanoyl]amino]-4-methylsulfanylbutanoic acid
CID 107570768

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid?
The IUPAC name of (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid (CID 107565006) is (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid.
What is the SMILES notation for (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid?
The canonical SMILES for (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid is C=CCC(N)C(=O)N[C@H](CCC)C(=O)O.
What is the InChIKey of (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid?
The InChIKey is LSGSTIVNKQEUCL-BRFYHDHCSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-3-5-7(11)9(13)12-8(6-4-2)10(14)15/h3,7-8H,1,4-6,11H2,2H3,(H,12,13)(H,14,15)/t7?,8-/m1/s1.
What are the key properties of (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid?
(2R)-2-(2-aminopent-4-enoylamino)pentanoic acid has a molecular weight of 214.26 g/mol, XLogP of 0.26, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-aminopent-4-enoylamino)pentanoic acid is sourced from PubChem (CID 107565006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).