2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid

C8H18N2O4 — CID 87257190

IUPAC2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid
SMILESCCC(C)[C@@H](N)C(=O)O.NCC(=O)O
InChIInChI=1S/C6H13NO2.C2H5NO2/c1-3-4(2)5(7)6(8)9;3-1-2(4)5/h4-5H,3,7H2,1-2H3,(H,8,9);1,3H2,(H,4,5)/t4?,5-;/m1./s1
InChIKeyMNQVNFIVCSQNGY-VVNPLDQHSA-N
MW206.24 g/mol
LogP-0.53
Rot. Bonds4

About 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid

2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid (PubChem CID 87257190) has the molecular formula C8H18N2O4 and a molecular weight of 206.24 g/mol. Its IUPAC name is 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid.

Molecular Properties

Compound Name2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid
PubChem CID87257190
Molecular FormulaC8H18N2O4
Molecular Weight206.24 g/mol
Exact Mass206.13
IUPAC Name2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid
SMILESCCC(C)[C@@H](N)C(=O)O.NCC(=O)O
InChIInChI=1S/C6H13NO2.C2H5NO2/c1-3-4(2)5(7)6(8)9;3-1-2(4)5/h4-5H,3,7H2,1-2H3,(H,8,9);1,3H2,(H,4,5)/t4?,5-;/m1./s1
InChIKeyMNQVNFIVCSQNGY-VVNPLDQHSA-N
XLogP-0.53
TPSA126.64 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 5-0.53
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

2-aminoacetic acid;2-amino-3-methylpentanoic acid;2-aminopropanoic acid
CID 18783681
(2S,3S)-2-amino-3-(113C)methylpentanoic acid
CID 10606774
(2S,3S)-2-(15N)azanyl-3-methylpentanoic acid
CID 10678279
(2S,3R)-2-amino-3-methylpentanoic acid;hydrate
CID 162355380
sodium (2S,3S)-2-amino-3-methylpentanoic acid
CID 71594993
2-amino-3-methylpentanoic acid;manganese
CID 175109832
2-amino-3-methylpentanoic acid;azane
CID 87185080
2-amino-3-methylpentanoic acid;hydrochloride
CID 13000955
lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride
CID 173147542
bis((2S,3S)-2-amino-3-methylpentanoic acid);formaldehyde
CID 174851375
2-aminoacetic acid;2-amino-3-methylpentanoic acid;2-aminopentanedioic acid
CID 174800417
2-amino-3-hydroxybutanoic acid;2-amino-3-methylpentanoic acid
CID 22316344

Frequently Asked Questions

What is the IUPAC name of 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid?
The IUPAC name of 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid (CID 87257190) is 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid.
What is the SMILES notation for 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid?
The canonical SMILES for 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid is CCC(C)[C@@H](N)C(=O)O.NCC(=O)O.
What is the InChIKey of 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid?
The InChIKey is MNQVNFIVCSQNGY-VVNPLDQHSA-N. The full InChI is InChI=1S/C6H13NO2.C2H5NO2/c1-3-4(2)5(7)6(8)9;3-1-2(4)5/h4-5H,3,7H2,1-2H3,(H,8,9);1,3H2,(H,4,5)/t4?,5-;/m1./s1.
What are the key properties of 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid?
2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid has a molecular weight of 206.24 g/mol, XLogP of -0.53, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid is sourced from PubChem (CID 87257190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).