2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid

C10H19N3O5 — CID 22268904

IUPAC2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid
SMILESNC(=O)CCC(N)C(=O)O.O=C(O)C1CCCN1
InChIInChI=1S/C5H10N2O3.C5H9NO2/c6-3(5(9)10)1-2-4(7)8;7-5(8)4-2-1-3-6-4/h3H,1-2,6H2,(H2,7,8)(H,9,10);4,6H,1-3H2,(H,7,8)
InChIKeyVKYBWTVHQHFSJL-UHFFFAOYSA-N
MW261.28 g/mol
LogP-1.51
Rot. Bonds5

About 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid

2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid (PubChem CID 22268904) has the molecular formula C10H19N3O5 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid
PubChem CID22268904
Molecular FormulaC10H19N3O5
Molecular Weight261.28 g/mol
Exact Mass261.13
IUPAC Name2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid
SMILESNC(=O)CCC(N)C(=O)O.O=C(O)C1CCCN1
InChIInChI=1S/C5H10N2O3.C5H9NO2/c6-3(5(9)10)1-2-4(7)8;7-5(8)4-2-1-3-6-4/h3H,1-2,6H2,(H2,7,8)(H,9,10);4,6H,1-3H2,(H,7,8)
InChIKeyVKYBWTVHQHFSJL-UHFFFAOYSA-N
XLogP-1.51
TPSA155.74 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 5-1.51
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-acetamido-3-methylbutanoic acid;(2S)-2-amino-3-methylbutanoic acid;(2S)-2,5-diamino-5-oxopentanoic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 23551163
2-amino-3-methylbutanoic acid;2-aminopentanedioic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 174509456
(2S)-2,6-diaminohexanoic acid;bis((2S)-pyrrolidine-2-carboxylic acid)
CID 161069597
2,6-diamino-5-hydroxyhexanoic acid;pyrrolidine-2-carboxylic acid
CID 22099142
2-aminoacetic acid;2-amino-3-hydroxybutanoic acid;2-amino-3-hydroxypropanoic acid;2,4-diamino-4-oxobutanoic acid;2,5-diamino-5-oxopentanoic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 174852664
(2R)-2-amino-4-methylsulfanylbutanoic acid;(2R)-pyrrolidine-2-carboxylic acid
CID 141203055
bis((2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid);(2S)-pyrrolidine-2-carboxylic acid
CID 118395312
(2S)-2-aminopentanedioic acid;(2S)-2-amino-3-phenylpropanoic acid;(2S)-2,5-diamino-5-oxopentanoic acid;(2S)-2,5-diaminopentanoic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 159928961
2-aminoacetic acid;bis((2S)-2-amino-3-methylbutanoic acid);(2S)-2-aminopentanediamide;(2S)-2-aminopropanoic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 23551194
2-aminoacetic acid;(2S)-2-amino-4-methylpentanoic acid;(2S)-2-amino-3-phenylpropanoic acid;(2S)-2,5-diamino-5-oxopentanoic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 160916856
bis(2-aminoacetic acid);(2S)-2,6-diaminohexanoic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 67117699
(2S)-2-amino-4-methylpentanoic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 66790467

Frequently Asked Questions

What is the IUPAC name of 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid?
The IUPAC name of 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid (CID 22268904) is 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid.
What is the SMILES notation for 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid?
The canonical SMILES for 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid is NC(=O)CCC(N)C(=O)O.O=C(O)C1CCCN1.
What is the InChIKey of 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid?
The InChIKey is VKYBWTVHQHFSJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O3.C5H9NO2/c6-3(5(9)10)1-2-4(7)8;7-5(8)4-2-1-3-6-4/h3H,1-2,6H2,(H2,7,8)(H,9,10);4,6H,1-3H2,(H,7,8).
What are the key properties of 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid?
2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid has a molecular weight of 261.28 g/mol, XLogP of -1.51, 5 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diamino-5-oxopentanoic acid;pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 22268904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).