N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine

C6H5IN2O — CID 131847169

IUPACN-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine
SMILESON=Cc1ccc(I)nc1
InChIInChI=1S/C6H5IN2O/c7-6-2-1-5(3-8-6)4-9-10/h1-4,10H
InChIKeyHIUZCHIQSMENQP-UHFFFAOYSA-N
MW248.02 g/mol
LogP1.49
Rot. Bonds1

About N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine

N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine (PubChem CID 131847169) has the molecular formula C6H5IN2O and a molecular weight of 248.02 g/mol. Its IUPAC name is N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine.

Molecular Properties

Compound NameN-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine
PubChem CID131847169
Molecular FormulaC6H5IN2O
Molecular Weight248.02 g/mol
Exact Mass247.94
IUPAC NameN-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine
SMILESON=Cc1ccc(I)nc1
InChIInChI=1S/C6H5IN2O/c7-6-2-1-5(3-8-6)4-9-10/h1-4,10H
InChIKeyHIUZCHIQSMENQP-UHFFFAOYSA-N
XLogP1.49
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.02
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', '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

(NZ)-N-[(6-chloro-3-pyridinyl)methylidene]hydroxylamine
CID 55279774
N-[(6-tert-butylsulfanyl-3-pyridinyl)methylidene]hydroxylamine
CID 131847200
(NZ)-N-[[6-(methylamino)-3-pyridinyl]methylidene]hydroxylamine
CID 124502737
(NZ)-N-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methylidene]hydroxylamine
CID 124502943
(NE)-N-(quinazolin-6-ylmethylidene)hydroxylamine
CID 119083203
N-[(6-iodo-4-methyl-3-pyridinyl)methylidene]hydroxylamine
CID 131847202
(NZ)-N-[[4-(pyridin-4-ylmethoxy)phenyl]methylidene]hydroxylamine
CID 39869732
2-iodo-5-[(E)-2-nitroethenyl]pyridine
CID 119082655
(NZ)-N-[(3-fluoro-4-iodophenyl)methylidene]hydroxylamine
CID 87871003
N-(pyridin-4-ylmethylidene)hydroxylamine
CID 159045467
N-[(4-bromophenyl)methylidene]hydroxylamine
CID 608088
N-(1,2-benzothiazol-5-ylmethylidene)hydroxylamine
CID 131845316

Frequently Asked Questions

What is the IUPAC name of N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine?
The IUPAC name of N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine (CID 131847169) is N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine.
What is the SMILES notation for N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine?
The canonical SMILES for N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine is ON=Cc1ccc(I)nc1.
What is the InChIKey of N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine?
The InChIKey is HIUZCHIQSMENQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5IN2O/c7-6-2-1-5(3-8-6)4-9-10/h1-4,10H.
What are the key properties of N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine?
N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine has a molecular weight of 248.02 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-iodo-3-pyridinyl)methylidene]hydroxylamine is sourced from PubChem (CID 131847169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).