(Z)-2-hydroxy-2-methylhex-3-enamide

C7H13NO2 — CID 146609859

IUPAC(Z)-2-hydroxy-2-methylhex-3-enamide
SMILESCC/C=C\C(C)(O)C(N)=O
InChIInChI=1S/C7H13NO2/c1-3-4-5-7(2,10)6(8)9/h4-5,10H,3H2,1-2H3,(H2,8,9)/b5-4-
InChIKeyTUSXMNBFHDUPGS-PLNGDYQASA-N
MW143.19 g/mol
LogP0.19
Rot. Bonds3

About (Z)-2-hydroxy-2-methylhex-3-enamide

(Z)-2-hydroxy-2-methylhex-3-enamide (PubChem CID 146609859) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (Z)-2-hydroxy-2-methylhex-3-enamide.

Molecular Properties

Compound Name(Z)-2-hydroxy-2-methylhex-3-enamide
PubChem CID146609859
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(Z)-2-hydroxy-2-methylhex-3-enamide
SMILESCC/C=C\C(C)(O)C(N)=O
InChIInChI=1S/C7H13NO2/c1-3-4-5-7(2,10)6(8)9/h4-5,10H,3H2,1-2H3,(H2,8,9)/b5-4-
InChIKeyTUSXMNBFHDUPGS-PLNGDYQASA-N
XLogP0.19
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.19
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

2,2-dimethyloct-5-enamide
CID 174985624
carbamic acid;(Z)-hex-3-ene
CID 158256779
carbamic acid;hex-3-ene
CID 175321124
ethyl (E)-2,2-dimethylhex-3-enoate
CID 21487406
(E)-2-(methylamino)hex-3-en-2-ol
CID 152934971
(E)-2,2-dimethylhept-4-en-3-one
CID 12757137
(E)-2,2-dimethylhex-3-ene
CID 5357261
methyl 2-hydroxy-2-methylocta-3,5-dienoate
CID 71407260
2,2-dimethylpropyl pent-2-enoate
CID 141038283
pent-2-ene-1,1,1-triamine
CID 91102245
2,2-dihydroxybutanamide
CID 22465138
but-1-ene;urea
CID 87757370

Frequently Asked Questions

What is the IUPAC name of (Z)-2-hydroxy-2-methylhex-3-enamide?
The IUPAC name of (Z)-2-hydroxy-2-methylhex-3-enamide (CID 146609859) is (Z)-2-hydroxy-2-methylhex-3-enamide.
What is the SMILES notation for (Z)-2-hydroxy-2-methylhex-3-enamide?
The canonical SMILES for (Z)-2-hydroxy-2-methylhex-3-enamide is CC/C=C\C(C)(O)C(N)=O.
What is the InChIKey of (Z)-2-hydroxy-2-methylhex-3-enamide?
The InChIKey is TUSXMNBFHDUPGS-PLNGDYQASA-N. The full InChI is InChI=1S/C7H13NO2/c1-3-4-5-7(2,10)6(8)9/h4-5,10H,3H2,1-2H3,(H2,8,9)/b5-4-.
What are the key properties of (Z)-2-hydroxy-2-methylhex-3-enamide?
(Z)-2-hydroxy-2-methylhex-3-enamide has a molecular weight of 143.19 g/mol, XLogP of 0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-hydroxy-2-methylhex-3-enamide is sourced from PubChem (CID 146609859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).