(Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol

C8H15NO — CID 143962868

IUPAC(Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol
SMILESC=C(/C(N)=C(\C)O)C(C)C
InChIInChI=1S/C8H15NO/c1-5(2)6(3)8(9)7(4)10/h5,10H,3,9H2,1-2,4H3/b8-7-
InChIKeyRUEYRDNWVANRSD-FPLPWBNLSA-N
MW141.21 g/mol
LogP1.95
Rot. Bonds2

About (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol

(Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol (PubChem CID 143962868) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol.

Molecular Properties

Compound Name(Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol
PubChem CID143962868
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol
SMILESC=C(/C(N)=C(\C)O)C(C)C
InChIInChI=1S/C8H15NO/c1-5(2)6(3)8(9)7(4)10/h5,10H,3,9H2,1-2,4H3/b8-7-
InChIKeyRUEYRDNWVANRSD-FPLPWBNLSA-N
XLogP1.95
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2E,4E)-6-amino-5-(2-fluoropropan-2-yl)hepta-2,4,6-trien-2-ol
CID 166648367
(2E,4E)-5-amino-3,6-dimethylocta-2,4-dien-2-ol
CID 130391029
(Z)-3-amino-5,5-dimethyl-4-methylidenehex-2-en-2-ol
CID 143962760
(2Z)-3-amino-4-methylpenta-2,4-dien-2-ol
CID 143962844
(Z)-3-amino-4-methylidenehex-2-en-2-ol
CID 143962853
(2Z,4Z)-3-amino-4-methylhepta-2,4-dien-2-ol
CID 144639004
(2E,4E)-5-amino-3,6-dimethylhepta-2,4,6-trien-2-ol
CID 146288833
2-Amino-3-ethyl-6-methylcyclohepta-1,3,6-trien-1-ol
CID 155204673
(2E,4Z)-6-amino-5-ethylhepta-2,4,6-trien-3-ol
CID 163642775
3-Amino-5-methyl-2-(2-methylprop-1-enyl)cyclohexa-1,3-dien-1-ol
CID 170370864
(2Z,6E)-3-amino-7,8,9-trimethyl-4-methylidenedeca-2,6,8-trien-2-ol
CID 174282510

Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol?
The IUPAC name of (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol (CID 143962868) is (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol.
What is the SMILES notation for (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol?
The canonical SMILES for (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol is C=C(/C(N)=C(\C)O)C(C)C.
What is the InChIKey of (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol?
The InChIKey is RUEYRDNWVANRSD-FPLPWBNLSA-N. The full InChI is InChI=1S/C8H15NO/c1-5(2)6(3)8(9)7(4)10/h5,10H,3,9H2,1-2,4H3/b8-7-.
What are the key properties of (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol?
(Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol has a molecular weight of 141.21 g/mol, XLogP of 1.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-5-methyl-4-methylidenehex-2-en-2-ol is sourced from PubChem (CID 143962868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).