1-butyl-2,2,3,3-tetramethylaziridine

C10H21N — CID 18717625

IUPAC1-butyl-2,2,3,3-tetramethylaziridine
SMILESCCCCN1C(C)(C)C1(C)C
InChIInChI=1S/C10H21N/c1-6-7-8-11-9(2,3)10(11,4)5/h6-8H2,1-5H3
InChIKeyAMDUQPWXBBMMCC-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.66
Rot. Bonds3

About 1-butyl-2,2,3,3-tetramethylaziridine

1-butyl-2,2,3,3-tetramethylaziridine (PubChem CID 18717625) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 1-butyl-2,2,3,3-tetramethylaziridine.

Molecular Properties

Compound Name1-butyl-2,2,3,3-tetramethylaziridine
PubChem CID18717625
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name1-butyl-2,2,3,3-tetramethylaziridine
SMILESCCCCN1C(C)(C)C1(C)C
InChIInChI=1S/C10H21N/c1-6-7-8-11-9(2,3)10(11,4)5/h6-8H2,1-5H3
InChIKeyAMDUQPWXBBMMCC-UHFFFAOYSA-N
XLogP2.66
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 1-butyl-2,2,3,3-tetramethylaziridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-butyl-2,2,6,6-tetramethylpiperidin-4-amine
CID 19905643
1-butyl-2,2,6,6-tetramethylpiperidin-3-amine
CID 142764448
1-butyl-2,2,4,4-tetramethylpyrrolidine
CID 143377523
1-butyl-3-methyl-1,3-diazetidine
CID 54539532
1-butyl-2,2,6,6-tetramethyl-1,2,6-azadisilinane
CID 14195383
15-butyl-1-ethyl-8-methyl-15-azatetracyclo[6.6.1.02,7.09,14]pentadeca-2,4,6,9,11,13-hexaene;oxalic acid
CID 21392066
hexane;methylsulfanylmethane
CID 161474362
1-butyl-3-ethyl-5-methyl-5-(sulfanylmethyl)imidazolidine-2,4-dione
CID 87234060
(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl) (E)-but-2-enoate
CID 139832038
1-butyl-5,5-dimethylpyrrolidin-2-one
CID 14887124
1-butyl-2-methyl-2-propylpyrrolidine;ethane
CID 170624322
1-dodecyl-3,3-dimethyl-4-methylideneazetidin-2-one
CID 102412122

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2,2,3,3-tetramethylaziridine?
The IUPAC name of 1-butyl-2,2,3,3-tetramethylaziridine (CID 18717625) is 1-butyl-2,2,3,3-tetramethylaziridine.
What is the SMILES notation for 1-butyl-2,2,3,3-tetramethylaziridine?
The canonical SMILES for 1-butyl-2,2,3,3-tetramethylaziridine is CCCCN1C(C)(C)C1(C)C.
What is the InChIKey of 1-butyl-2,2,3,3-tetramethylaziridine?
The InChIKey is AMDUQPWXBBMMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-6-7-8-11-9(2,3)10(11,4)5/h6-8H2,1-5H3.
What are the key properties of 1-butyl-2,2,3,3-tetramethylaziridine?
1-butyl-2,2,3,3-tetramethylaziridine has a molecular weight of 155.28 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2,2,3,3-tetramethylaziridine is sourced from PubChem (CID 18717625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).