N-hept-6-enylidenehydroxylamine

C7H13NO — CID 153435939

IUPACN-hept-6-enylidenehydroxylamine
SMILESC=CCCCCC=NO
InChIInChI=1S/C7H13NO/c1-2-3-4-5-6-7-8-9/h2,7,9H,1,3-6H2
InChIKeyNAZKHAYSMUNVGV-UHFFFAOYSA-N
MW127.19 g/mol
LogP2.19
Rot. Bonds5

About N-hept-6-enylidenehydroxylamine

N-hept-6-enylidenehydroxylamine (PubChem CID 153435939) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is N-hept-6-enylidenehydroxylamine.

Molecular Properties

Compound NameN-hept-6-enylidenehydroxylamine
PubChem CID153435939
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC NameN-hept-6-enylidenehydroxylamine
SMILESC=CCCCCC=NO
InChIInChI=1S/C7H13NO/c1-2-3-4-5-6-7-8-9/h2,7,9H,1,3-6H2
InChIKeyNAZKHAYSMUNVGV-UHFFFAOYSA-N
XLogP2.19
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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

N-dec-9-enylidenehydroxylamine
CID 175541628
N-(12-hydroxyiminododecylidene)hydroxylamine
CID 131876535
(NE)-N-[(5Z)-5-hydroxyiminopentylidene]hydroxylamine
CID 5356166
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
(NE)-N-octylidenehydroxylamine
CID 5385260
(9E)-9-hydroxyiminononanoic acid
CID 135344053
2-(undec-10-enylideneamino)ethanamine
CID 121341438
(5E)-5-hydroxyiminopentanenitrile
CID 10011867
N-(3-ethenoxypropylidene)hydroxylamine
CID 157385181
heptahexaconta-1,23,66-triene
CID 57275880
icosa-1,9,19-triene
CID 57001912

Frequently Asked Questions

What is the IUPAC name of N-hept-6-enylidenehydroxylamine?
The IUPAC name of N-hept-6-enylidenehydroxylamine (CID 153435939) is N-hept-6-enylidenehydroxylamine.
What is the SMILES notation for N-hept-6-enylidenehydroxylamine?
The canonical SMILES for N-hept-6-enylidenehydroxylamine is C=CCCCCC=NO.
What is the InChIKey of N-hept-6-enylidenehydroxylamine?
The InChIKey is NAZKHAYSMUNVGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-2-3-4-5-6-7-8-9/h2,7,9H,1,3-6H2.
What are the key properties of N-hept-6-enylidenehydroxylamine?
N-hept-6-enylidenehydroxylamine has a molecular weight of 127.19 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hept-6-enylidenehydroxylamine is sourced from PubChem (CID 153435939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).