N-(1-thiophen-2-ylhexylidene)hydroxylamine

C10H15NOS — CID 86128638

IUPACN-(1-thiophen-2-ylhexylidene)hydroxylamine
SMILESCCCCCC(=NO)c1cccs1
InChIInChI=1S/C10H15NOS/c1-2-3-4-6-9(11-12)10-7-5-8-13-10/h5,7-8,12H,2-4,6H2,1H3
InChIKeyDNZSGPPDGNNAKA-UHFFFAOYSA-N
MW197.30 g/mol
LogP3.51
Rot. Bonds5

About N-(1-thiophen-2-ylhexylidene)hydroxylamine

N-(1-thiophen-2-ylhexylidene)hydroxylamine (PubChem CID 86128638) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is N-(1-thiophen-2-ylhexylidene)hydroxylamine.

Molecular Properties

Compound NameN-(1-thiophen-2-ylhexylidene)hydroxylamine
PubChem CID86128638
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC NameN-(1-thiophen-2-ylhexylidene)hydroxylamine
SMILESCCCCCC(=NO)c1cccs1
InChIInChI=1S/C10H15NOS/c1-2-3-4-6-9(11-12)10-7-5-8-13-10/h5,7-8,12H,2-4,6H2,1H3
InChIKeyDNZSGPPDGNNAKA-UHFFFAOYSA-N
XLogP3.51
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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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Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylhexylidene)hydroxylamine?
The IUPAC name of N-(1-thiophen-2-ylhexylidene)hydroxylamine (CID 86128638) is N-(1-thiophen-2-ylhexylidene)hydroxylamine.
What is the SMILES notation for N-(1-thiophen-2-ylhexylidene)hydroxylamine?
The canonical SMILES for N-(1-thiophen-2-ylhexylidene)hydroxylamine is CCCCCC(=NO)c1cccs1.
What is the InChIKey of N-(1-thiophen-2-ylhexylidene)hydroxylamine?
The InChIKey is DNZSGPPDGNNAKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c1-2-3-4-6-9(11-12)10-7-5-8-13-10/h5,7-8,12H,2-4,6H2,1H3.
What are the key properties of N-(1-thiophen-2-ylhexylidene)hydroxylamine?
N-(1-thiophen-2-ylhexylidene)hydroxylamine has a molecular weight of 197.30 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-2-ylhexylidene)hydroxylamine is sourced from PubChem (CID 86128638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).