O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine

C8H15NO — CID 146533192

IUPACO-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine
SMILESC/C=C\C=C(/ON)C(C)C
InChIInChI=1S/C8H15NO/c1-4-5-6-8(10-9)7(2)3/h4-7H,9H2,1-3H3/b5-4-,8-6-
InChIKeyRKMFAUHOGMJQNH-NADLECRISA-N
MW141.21 g/mol
LogP1.99
Rot. Bonds3

About O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine

O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine (PubChem CID 146533192) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine.

Molecular Properties

Compound NameO-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine
PubChem CID146533192
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameO-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine
SMILESC/C=C\C=C(/ON)C(C)C
InChIInChI=1S/C8H15NO/c1-4-5-6-8(10-9)7(2)3/h4-7H,9H2,1-3H3/b5-4-,8-6-
InChIKeyRKMFAUHOGMJQNH-NADLECRISA-N
XLogP1.99
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1Z,3Z,5Z)-3-propan-2-ylhepta-1,3,5-trien-1-amine
CID 126626487
2-methyl-N'-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]propanimidamide
CID 167223912
(2E,4Z)-2-propan-2-ylhexa-2,4-dienenitrile
CID 147215892
ethane;(3Z,5Z)-3-propan-2-ylhepta-1,3,5-triene
CID 142182203
N-[(2Z,4Z)-2-propan-2-ylhexa-2,4-dienoxy]methanamine
CID 134290126
[(2Z,4E)-6,7-dimethylnona-2,4-dien-5-yl] cyanate
CID 139442716
(2E,4E)-5-ethyl-7-methylocta-2,4-diene
CID 173194163
(2Z,4E)-5-bromo-7-methyl-6-methylideneocta-2,4-diene
CID 172586692
(2Z,4Z)-6-fluoro-5-methylhepta-2,4-diene
CID 143911112
(2Z,4Z)-2-hydrazinyl-N-propan-2-ylhexa-2,4-dienamide
CID 134458222
ethane;(3E,5Z)-3-propan-2-yloxyhepta-1,3,5-triene
CID 143474027
(2Z,4E,6E)-octa-2,4,6-trien-4-amine
CID 89113450

Frequently Asked Questions

What is the IUPAC name of O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine?
The IUPAC name of O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine (CID 146533192) is O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine.
What is the SMILES notation for O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine?
The canonical SMILES for O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine is C/C=C\C=C(/ON)C(C)C.
What is the InChIKey of O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine?
The InChIKey is RKMFAUHOGMJQNH-NADLECRISA-N. The full InChI is InChI=1S/C8H15NO/c1-4-5-6-8(10-9)7(2)3/h4-7H,9H2,1-3H3/b5-4-,8-6-.
What are the key properties of O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine?
O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine has a molecular weight of 141.21 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(3Z,5Z)-2-methylhepta-3,5-dien-3-yl]hydroxylamine is sourced from PubChem (CID 146533192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).