N-butyl-N-phenylmethaneselenoamide

C11H15NSe — CID 10490195

IUPACN-butyl-N-phenylmethaneselenoamide
SMILESCCCCN(C=[Se])c1ccccc1
InChIInChI=1S/C11H15NSe/c1-2-3-9-12(10-13)11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3
InChIKeyQVMYZCRKDHNGRC-UHFFFAOYSA-N
MW240.21 g/mol
LogP2.22
Rot. Bonds5

About N-butyl-N-phenylmethaneselenoamide

N-butyl-N-phenylmethaneselenoamide (PubChem CID 10490195) has the molecular formula C11H15NSe and a molecular weight of 240.21 g/mol. Its IUPAC name is N-butyl-N-phenylmethaneselenoamide.

Molecular Properties

Compound NameN-butyl-N-phenylmethaneselenoamide
PubChem CID10490195
Molecular FormulaC11H15NSe
Molecular Weight240.21 g/mol
Exact Mass241.04
IUPAC NameN-butyl-N-phenylmethaneselenoamide
SMILESCCCCN(C=[Se])c1ccccc1
InChIInChI=1S/C11H15NSe/c1-2-3-9-12(10-13)11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3
InChIKeyQVMYZCRKDHNGRC-UHFFFAOYSA-N
XLogP2.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.21
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-phenylmethaneselenoamide?
The IUPAC name of N-butyl-N-phenylmethaneselenoamide (CID 10490195) is N-butyl-N-phenylmethaneselenoamide.
What is the SMILES notation for N-butyl-N-phenylmethaneselenoamide?
The canonical SMILES for N-butyl-N-phenylmethaneselenoamide is CCCCN(C=[Se])c1ccccc1.
What is the InChIKey of N-butyl-N-phenylmethaneselenoamide?
The InChIKey is QVMYZCRKDHNGRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NSe/c1-2-3-9-12(10-13)11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3.
What are the key properties of N-butyl-N-phenylmethaneselenoamide?
N-butyl-N-phenylmethaneselenoamide has a molecular weight of 240.21 g/mol, XLogP of 2.22, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-phenylmethaneselenoamide is sourced from PubChem (CID 10490195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).