2-[[(Z)-pent-3-en-2-yl]amino]acetic acid

C7H13NO2 — CID 143858966

IUPAC2-[[(Z)-pent-3-en-2-yl]amino]acetic acid
SMILESC/C=C\C(C)NCC(=O)O
InChIInChI=1S/C7H13NO2/c1-3-4-6(2)8-5-7(9)10/h3-4,6,8H,5H2,1-2H3,(H,9,10)/b4-3-
InChIKeyMZTZEHTYIRRHBB-ARJAWSKDSA-N
MW143.19 g/mol
LogP0.63
Rot. Bonds4

About 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid

2-[[(Z)-pent-3-en-2-yl]amino]acetic acid (PubChem CID 143858966) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid.

Molecular Properties

Compound Name2-[[(Z)-pent-3-en-2-yl]amino]acetic acid
PubChem CID143858966
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name2-[[(Z)-pent-3-en-2-yl]amino]acetic acid
SMILESC/C=C\C(C)NCC(=O)O
InChIInChI=1S/C7H13NO2/c1-3-4-6(2)8-5-7(9)10/h3-4,6,8H,5H2,1-2H3,(H,9,10)/b4-3-
InChIKeyMZTZEHTYIRRHBB-ARJAWSKDSA-N
XLogP0.63
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(carboxymethylamino)propanoic acid
CID 2764308
(2S)-2-(carboxymethylamino)-4-methylpentanoic acid
CID 15691184
2-[1-(diaminomethylideneamino)ethylamino]acetic acid
CID 87120373
2-[[(2S)-but-3-yn-2-yl]amino]acetic acid
CID 135221499
N-benzylpent-3-en-2-amine
CID 71339896
2-[[1-oxo-1-(propan-2-ylamino)propan-2-yl]amino]acetic acid
CID 43466197
2-[1-(dimethylamino)propan-2-ylamino]acetic acid
CID 82937754
(3R)-3-hydroxyhex-4-enoic acid
CID 54147030
(E)-4,5-dimethyloct-6-enoic acid
CID 155168801
2-[(1-amino-3-hydroxybutan-2-yl)amino]acetic acid
CID 87428208
2-[(1-amino-4-methylpent-3-en-2-yl)amino]acetic acid
CID 88704450
3-[[(2R)-2-(carboxymethylamino)propanoyl]amino]propanoic acid
CID 88998079

Frequently Asked Questions

What is the IUPAC name of 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid?
The IUPAC name of 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid (CID 143858966) is 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid.
What is the SMILES notation for 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid?
The canonical SMILES for 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid is C/C=C\C(C)NCC(=O)O.
What is the InChIKey of 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid?
The InChIKey is MZTZEHTYIRRHBB-ARJAWSKDSA-N. The full InChI is InChI=1S/C7H13NO2/c1-3-4-6(2)8-5-7(9)10/h3-4,6,8H,5H2,1-2H3,(H,9,10)/b4-3-.
What are the key properties of 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid?
2-[[(Z)-pent-3-en-2-yl]amino]acetic acid has a molecular weight of 143.19 g/mol, XLogP of 0.63, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(Z)-pent-3-en-2-yl]amino]acetic acid is sourced from PubChem (CID 143858966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).