N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine

C13H15NO — CID 174657798

IUPACN-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine
SMILESC=Cc1ccc2c(c1)CCCC2C=NO
InChIInChI=1S/C13H15NO/c1-2-10-6-7-13-11(8-10)4-3-5-12(13)9-14-15/h2,6-9,12,15H,1,3-5H2
InChIKeyFFVDCKBQWWUUKK-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.21
Rot. Bonds2

About N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine

N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine (PubChem CID 174657798) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine.

Molecular Properties

Compound NameN-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine
PubChem CID174657798
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC NameN-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine
SMILESC=Cc1ccc2c(c1)CCCC2C=NO
InChIInChI=1S/C13H15NO/c1-2-10-6-7-13-11(8-10)4-3-5-12(13)9-14-15/h2,6-9,12,15H,1,3-5H2
InChIKeyFFVDCKBQWWUUKK-UHFFFAOYSA-N
XLogP3.21
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.21
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

(1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130914652
N-[(7-bromo-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine
CID 175174429
5-ethenyl-2,3-dihydro-1H-indene
CID 59801498
N-[[3-cyclopentyl-2-(4-ethenylphenyl)cyclopent-2-en-1-yl]methylidene]hydroxylamine
CID 174541917
N-[(7-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine
CID 174750219
7-ethenyl-4-methyl-3-methylidene-2,4-dihydro-1H-naphthalene
CID 145472095
1,2-dicyclohexyl-4-ethenylbenzene
CID 23508601
6-ethenyl-3,4-dihydro-2H-chromene
CID 23503811
(E)-3-[(5S)-5-amino-5,6,7,8-tetrahydronaphthalen-2-yl]prop-2-enenitrile
CID 59747934
2,6-bis(ethenyl)-9,10-dihydroanthracene
CID 102252812
3-ethenyl-N-methylbicyclo[4.2.0]octa-1(6),2,4-trien-7-amine
CID 118200555
ethyl 5-formyl-5,6,7,8-tetrahydronaphthalene-2-carboxylate
CID 21289481

Frequently Asked Questions

What is the IUPAC name of N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine?
The IUPAC name of N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine (CID 174657798) is N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine.
What is the SMILES notation for N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine?
The canonical SMILES for N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine is C=Cc1ccc2c(c1)CCCC2C=NO.
What is the InChIKey of N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine?
The InChIKey is FFVDCKBQWWUUKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-2-10-6-7-13-11(8-10)4-3-5-12(13)9-14-15/h2,6-9,12,15H,1,3-5H2.
What are the key properties of N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine?
N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine has a molecular weight of 201.27 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine is sourced from PubChem (CID 174657798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).