N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine

C11H13NO — CID 139781117

IUPACN-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
SMILESCc1ccc2c(c1)CCCC2=NO
InChIInChI=1S/C11H13NO/c1-8-5-6-10-9(7-8)3-2-4-11(10)12-13/h5-7,13H,2-4H2,1H3
InChIKeySEHAVVQCSIKXMA-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.51
Rot. Bonds

About N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine

N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine (PubChem CID 139781117) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
PubChem CID139781117
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC NameN-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
SMILESCc1ccc2c(c1)CCCC2=NO
InChIInChI=1S/C11H13NO/c1-8-5-6-10-9(7-8)3-2-4-11(10)12-13/h5-7,13H,2-4H2,1H3
InChIKeySEHAVVQCSIKXMA-UHFFFAOYSA-N
XLogP2.51
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.51
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

Acetophenone oxime
CID 5464950
Benzophenone oxime
CID 11324
Acetophenonoxime
CID 69185
Ethanone, 1,2-diphenyl-, oxime
CID 5355453
N-[1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethylidene]hydroxylamine
CID 2747574
6,7,8,9-Tetrahydro-benzocyclohepten-5-one oxime
CID 5381210
2-Naphthaldehyde oxime
CID 9563142
2,3-Dihydro-1H-phenanthren-4-one oxime
CID 9579790
(NE)-N-[3,3-dimethyl-5-(3-methylphenyl)-2H-inden-1-ylidene]hydroxylamine
CID 45483835
1,2,3,4-Tetrahydronaphthalen-1-one oxime
CID 5483123
1-Phenyl-1-ethanone oxime
CID 5324612
(1Z)-1-(4-Methylphenyl)ethanone oxime
CID 5385523

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The IUPAC name of N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine (CID 139781117) is N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine.
What is the SMILES notation for N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The canonical SMILES for N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine is Cc1ccc2c(c1)CCCC2=NO.
What is the InChIKey of N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The InChIKey is SEHAVVQCSIKXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-8-5-6-10-9(7-8)3-2-4-11(10)12-13/h5-7,13H,2-4H2,1H3.
What are the key properties of N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine has a molecular weight of 175.23 g/mol, XLogP of 2.51, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine is sourced from PubChem (CID 139781117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).