(NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine

C8H9NO — CID 143706516

IUPAC(NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine
SMILESC=C1C=CCC=C/C1=N/O
InChIInChI=1S/C8H9NO/c1-7-5-3-2-4-6-8(7)9-10/h3-6,10H,1-2H2/b9-8-
InChIKeyUJPGCWPKBBWWHK-HJWRWDBZSA-N
MW135.17 g/mol
LogP1.89
Rot. Bonds

About (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine

(NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine (PubChem CID 143706516) has the molecular formula C8H9NO and a molecular weight of 135.17 g/mol. Its IUPAC name is (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine
PubChem CID143706516
Molecular FormulaC8H9NO
Molecular Weight135.17 g/mol
Exact Mass135.07
IUPAC Name(NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine
SMILESC=C1C=CCC=C/C1=N/O
InChIInChI=1S/C8H9NO/c1-7-5-3-2-4-6-8(7)9-10/h3-6,10H,1-2H2/b9-8-
InChIKeyUJPGCWPKBBWWHK-HJWRWDBZSA-N
XLogP1.89
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-fluoro-6-methylidenecyclohexa-1,4-diene
CID 135427159
2-cyclohexa-2,5-dien-1-ylidenepropane-1,3-diamine
CID 143128858
cyclopropene
CID 141033262
2-methylidenecyclopent-3-en-1-one
CID 15805386
cyclopropene;phenylboronic acid
CID 175112144
cyclohexa-2,5-dien-1-one;ethane
CID 90976592
(4Z)-cyclonona-1,4,7-triene
CID 123743904
cyclohexa-1,4-diene
CID 12343
(2Z,4E)-2-[(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]hexa-2,4-dien-3-amine
CID 89441659
N-(cyclopenta-1,4-dien-1-ylmethyl)methanimine
CID 163815905
(NZ)-N-cyclohex-2-en-1-ylidenehydroxylamine;hydrochloride
CID 88770127
ethane;ethene;3-methylcyclohepta-1,3,5-triene
CID 144635732

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine (CID 143706516) is (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine is C=C1C=CCC=C/C1=N/O.
What is the InChIKey of (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine?
The InChIKey is UJPGCWPKBBWWHK-HJWRWDBZSA-N. The full InChI is InChI=1S/C8H9NO/c1-7-5-3-2-4-6-8(7)9-10/h3-6,10H,1-2H2/b9-8-.
What are the key properties of (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine?
(NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine has a molecular weight of 135.17 g/mol, XLogP of 1.89, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(7-methylidenecyclohepta-2,5-dien-1-ylidene)hydroxylamine is sourced from PubChem (CID 143706516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).