(2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide

C6H10N2O2 — CID 135140646

IUPAC(2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide
SMILESC/C=C(N)/C(O)=C/C(N)=O
InChIInChI=1S/C6H10N2O2/c1-2-4(7)5(9)3-6(8)10/h2-3,9H,7H2,1H3,(H2,8,10)/b4-2-,5-3-
InChIKeyXLBORFUATBKEIG-JVLMNHKTSA-N
MW142.16 g/mol
LogP-0.22
Rot. Bonds2

About (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide

(2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide (PubChem CID 135140646) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide.

Molecular Properties

Compound Name(2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide
PubChem CID135140646
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name(2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide
SMILESC/C=C(N)/C(O)=C/C(N)=O
InChIInChI=1S/C6H10N2O2/c1-2-4(7)5(9)3-6(8)10/h2-3,9H,7H2,1H3,(H2,8,10)/b4-2-,5-3-
InChIKeyXLBORFUATBKEIG-JVLMNHKTSA-N
XLogP-0.22
TPSA89.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(Z)-2-hydroxybut-2-enediamide
CID 142800168
methyl (E)-2-aminobut-2-enoate
CID 19894054
bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium
CID 59391475
2-hydroxybut-2-enamide;hydrochloride
CID 177282590
but-2-en-2-ol;urea
CID 173334764
(Z)-4-amino-2-[2-(methylamino)-2-oxoethyl]-4-oxobut-2-enoic acid
CID 152916197
2-amino-N-hydroxybut-2-enamide
CID 174640087
3-amino-4,4-dimethylpent-2-enamide
CID 143267378
(Z)-2-amino-N,N-dimethylbut-2-enamide
CID 166848992
(E)-2-amino-4-oxopent-2-enoic acid
CID 45085327
(Z)-4-amino-2-carbamoyl-4-oxobut-2-enoic acid
CID 22748582
(E)-3,4-diamino-4-oxobut-2-enoic acid
CID 59912426

Frequently Asked Questions

What is the IUPAC name of (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide?
The IUPAC name of (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide (CID 135140646) is (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide.
What is the SMILES notation for (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide?
The canonical SMILES for (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide is C/C=C(N)/C(O)=C/C(N)=O.
What is the InChIKey of (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide?
The InChIKey is XLBORFUATBKEIG-JVLMNHKTSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-2-4(7)5(9)3-6(8)10/h2-3,9H,7H2,1H3,(H2,8,10)/b4-2-,5-3-.
What are the key properties of (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide?
(2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide has a molecular weight of 142.16 g/mol, XLogP of -0.22, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide is sourced from PubChem (CID 135140646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).