(2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid

C6H10N2O5 — CID 150215384

IUPAC(2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid
SMILESNC(=O)CC[C@@H](NC(=O)O)C(=O)O
InChIInChI=1S/C6H10N2O5/c7-4(9)2-1-3(5(10)11)8-6(12)13/h3,8H,1-2H2,(H2,7,9)(H,10,11)(H,12,13)/t3-/m1/s1
InChIKeyFSJGGDNXBAWPGS-GSVOUGTGSA-N
MW190.16 g/mol
LogP-1.03
Rot. Bonds5

About (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid

(2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid (PubChem CID 150215384) has the molecular formula C6H10N2O5 and a molecular weight of 190.16 g/mol. Its IUPAC name is (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid.

Molecular Properties

Compound Name(2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid
PubChem CID150215384
Molecular FormulaC6H10N2O5
Molecular Weight190.16 g/mol
Exact Mass190.06
IUPAC Name(2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid
SMILESNC(=O)CC[C@@H](NC(=O)O)C(=O)O
InChIInChI=1S/C6H10N2O5/c7-4(9)2-1-3(5(10)11)8-6(12)13/h3,8H,1-2H2,(H2,7,9)(H,10,11)(H,12,13)/t3-/m1/s1
InChIKeyFSJGGDNXBAWPGS-GSVOUGTGSA-N
XLogP-1.03
TPSA129.72 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.16
LogP ≤ 5-1.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-5-oxo-2-(prop-1-en-2-ylamino)pentanoic acid
CID 142578734
5-amino-2-[[7-[(4-amino-1-carboxy-4-oxobutyl)amino]-7-oxoheptanoyl]amino]-5-oxopentanoic acid
CID 22096663
(4S)-4-(carboxyamino)-5-hydroxy-5-oxopentanoate
CID 102516015
2-[[4-[(4-acetamido-4-carboxybutanoyl)amino]-4-carboxybutanoyl]amino]-5-amino-5-oxopentanoic acid
CID 123933276
2-[[4-[[4-[[4-[[4-[[4-[[4-[[4-[[4-[(4-acetamido-4-carboxybutanoyl)amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-5-amino-5-oxopentanoic acid
CID 123280236
(2R)-5-amino-2-(4-aminopentanoylamino)-5-oxopentanoic acid
CID 114006011
(2S)-5-amino-5-oxo-2-[[(2S)-2-sulfanylpropanoyl]amino]pentanoic acid
CID 142184881
(2S)-5-amino-2-[[(2S)-2-aminopropanoyl]amino]-5-oxopentanoic acid;ethane
CID 178159244
(2S)-5-amino-2-[(2-amino-2-methylpropanoyl)amino]-5-oxopentanoic acid
CID 61267028
5-amino-2-[(1-carboxy-4-hydroxybutyl)carbamoylamino]-5-oxopentanoic acid
CID 123228019
5-amino-5-oxo-2-[(2-sulfoacetyl)amino]pentanoic acid
CID 175084988
2-acetamido-5-amino-5-oxopentanoic acid;2,5-diamino-5-oxopentanoic acid
CID 23191188

Frequently Asked Questions

What is the IUPAC name of (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid?
The IUPAC name of (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid (CID 150215384) is (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid.
What is the SMILES notation for (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid?
The canonical SMILES for (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid is NC(=O)CC[C@@H](NC(=O)O)C(=O)O.
What is the InChIKey of (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid?
The InChIKey is FSJGGDNXBAWPGS-GSVOUGTGSA-N. The full InChI is InChI=1S/C6H10N2O5/c7-4(9)2-1-3(5(10)11)8-6(12)13/h3,8H,1-2H2,(H2,7,9)(H,10,11)(H,12,13)/t3-/m1/s1.
What are the key properties of (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid?
(2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid has a molecular weight of 190.16 g/mol, XLogP of -1.03, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-amino-2-(carboxyamino)-5-oxopentanoic acid is sourced from PubChem (CID 150215384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).