N,N-dihexylbenzenecarboselenoamide

C19H31NSe — CID 11792306

IUPACN,N-dihexylbenzenecarboselenoamide
SMILESCCCCCCN(CCCCCC)C(=[Se])c1ccccc1
InChIInChI=1S/C19H31NSe/c1-3-5-7-12-16-20(17-13-8-6-4-2)19(21)18-14-10-9-11-15-18/h9-11,14-15H,3-8,12-13,16-17H2,1-2H3
InChIKeyJYKBTKDPIARLGA-UHFFFAOYSA-N
MW352.42 g/mol
LogP4.80
Rot. Bonds12

About N,N-dihexylbenzenecarboselenoamide

N,N-dihexylbenzenecarboselenoamide (PubChem CID 11792306) has the molecular formula C19H31NSe and a molecular weight of 352.42 g/mol. Its IUPAC name is N,N-dihexylbenzenecarboselenoamide.

Molecular Properties

Compound NameN,N-dihexylbenzenecarboselenoamide
PubChem CID11792306
Molecular FormulaC19H31NSe
Molecular Weight352.42 g/mol
Exact Mass353.16
IUPAC NameN,N-dihexylbenzenecarboselenoamide
SMILESCCCCCCN(CCCCCC)C(=[Se])c1ccccc1
InChIInChI=1S/C19H31NSe/c1-3-5-7-12-16-20(17-13-8-6-4-2)19(21)18-14-10-9-11-15-18/h9-11,14-15H,3-8,12-13,16-17H2,1-2H3
InChIKeyJYKBTKDPIARLGA-UHFFFAOYSA-N
XLogP4.80
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-hexyl-N-(2-hydroxyethyl)benzamide
CID 61215400
N,N-dimethylhexan-1-amine;1,2-diphenylethane-1,2-dione
CID 69012000
benzoic acid;N,N-dioctyloctan-1-amine
CID 68632101
N,N-dibutylbenzenecarbothioamide
CID 12716080
1,2-diphenylethane-1,2-dione;N-ethyl-N-methylhexan-1-amine
CID 69013221
benzoic acid;bis(N,N-dimethyldodecan-1-amine);hydrochloride
CID 175115715
1,1-dihexyl-3,3-diphenylthiourea
CID 20549673
(1-oxo-1-phenylpropan-2-yl) N,N-dihexylcarbamate
CID 164677097
3-fluoro-N,N-di(nonyl)benzamide
CID 533098
N-dodecyl-N-phenylhydroxylamine
CID 159931126
benzoic acid;dibutylcarbamic acid
CID 160812669
N-heptyl-N-pentylaniline
CID 154378615

Frequently Asked Questions

What is the IUPAC name of N,N-dihexylbenzenecarboselenoamide?
The IUPAC name of N,N-dihexylbenzenecarboselenoamide (CID 11792306) is N,N-dihexylbenzenecarboselenoamide.
What is the SMILES notation for N,N-dihexylbenzenecarboselenoamide?
The canonical SMILES for N,N-dihexylbenzenecarboselenoamide is CCCCCCN(CCCCCC)C(=[Se])c1ccccc1.
What is the InChIKey of N,N-dihexylbenzenecarboselenoamide?
The InChIKey is JYKBTKDPIARLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31NSe/c1-3-5-7-12-16-20(17-13-8-6-4-2)19(21)18-14-10-9-11-15-18/h9-11,14-15H,3-8,12-13,16-17H2,1-2H3.
What are the key properties of N,N-dihexylbenzenecarboselenoamide?
N,N-dihexylbenzenecarboselenoamide has a molecular weight of 352.42 g/mol, XLogP of 4.80, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dihexylbenzenecarboselenoamide is sourced from PubChem (CID 11792306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).