2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride

C7H15ClN2O3 — CID 73408744

IUPAC2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride
SMILESCCNC(=O)CCC(N)C(=O)O.Cl
InChIInChI=1S/C7H14N2O3.ClH/c1-2-9-6(10)4-3-5(8)7(11)12;/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12);1H
InChIKeyGPZPUVMAILBCED-UHFFFAOYSA-N
MW210.66 g/mol
LogP-0.26
Rot. Bonds5

About 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride

2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride (PubChem CID 73408744) has the molecular formula C7H15ClN2O3 and a molecular weight of 210.66 g/mol. Its IUPAC name is 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride.

Molecular Properties

Compound Name2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride
PubChem CID73408744
Molecular FormulaC7H15ClN2O3
Molecular Weight210.66 g/mol
Exact Mass210.08
IUPAC Name2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride
SMILESCCNC(=O)CCC(N)C(=O)O.Cl
InChIInChI=1S/C7H14N2O3.ClH/c1-2-9-6(10)4-3-5(8)7(11)12;/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12);1H
InChIKeyGPZPUVMAILBCED-UHFFFAOYSA-N
XLogP-0.26
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

copper;2-amino-5-(ethylamino)-5-oxopentanoic acid;sulfate
CID 174824189
2-amino-5-(ethylamino)-5-oxopentanoic acid;2-chloro-3-methyloxirane
CID 175078520
(2S)-2-amino-5-[[(2R)-2-carboxypropyl]amino]-5-oxopentanoic acid
CID 163083327
ethyl (2R)-2-amino-5-(ethylamino)-5-oxopentanoate
CID 71815737
(2S)-2-amino-5-[[(1R)-1-carboxypropyl]amino]-5-oxopentanoic acid
CID 129361384
[(2S)-2-amino-5-(ethylamino)-5-oxopentanoyl]-oxophosphanium
CID 175846430
2-amino-5-[[(1S)-1-carboxybutyl]amino]-5-oxopentanoic acid
CID 89120164
(2S)-4-amino-2-[[(2S)-2-amino-5-(ethylamino)-5-oxopentanoyl]amino]-4-oxobutanoic acid
CID 90954445
(2S)-5-amino-2-[[(2S)-2-amino-5-(ethylamino)-5-oxopentanoyl]amino]-5-oxopentanoic acid
CID 87920148
(2S)-2-amino-5-oxo-5-(propan-2-ylamino)pentanoic acid
CID 6993184
magnesium bis(3-[[(4S)-4-amino-4-carboxybutanoyl]amino]propanoate)
CID 139643109
(2S)-2-aminopentanedioic acid;trihydrochloride
CID 140679884

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride?
The IUPAC name of 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride (CID 73408744) is 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride.
What is the SMILES notation for 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride?
The canonical SMILES for 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride is CCNC(=O)CCC(N)C(=O)O.Cl.
What is the InChIKey of 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride?
The InChIKey is GPZPUVMAILBCED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3.ClH/c1-2-9-6(10)4-3-5(8)7(11)12;/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12);1H.
What are the key properties of 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride?
2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride has a molecular weight of 210.66 g/mol, XLogP of -0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(ethylamino)-5-oxopentanoic acid;hydrochloride is sourced from PubChem (CID 73408744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).