1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane

C11H21- — CID 91105645

IUPAC1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane
SMILES[CH2-]C1(C(C)(C)CC)CCC1C
InChIInChI=1S/C11H21/c1-6-10(3,4)11(5)8-7-9(11)2/h9H,5-8H2,1-4H3/q-1
InChIKeyWADZLQHCMVMBCR-UHFFFAOYSA-N
MW153.29 g/mol
LogP3.67
Rot. Bonds2

About 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane

1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane (PubChem CID 91105645) has the molecular formula C11H21- and a molecular weight of 153.29 g/mol. Its IUPAC name is 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane.

Molecular Properties

Compound Name1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane
PubChem CID91105645
Molecular FormulaC11H21-
Molecular Weight153.29 g/mol
Exact Mass153.16
IUPAC Name1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane
SMILES[CH2-]C1(C(C)(C)CC)CCC1C
InChIInChI=1S/C11H21/c1-6-10(3,4)11(5)8-7-9(11)2/h9H,5-8H2,1-4H3/q-1
InChIKeyWADZLQHCMVMBCR-UHFFFAOYSA-N
XLogP3.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.29
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-2-(2-methylbutan-2-yl)bicyclo[3.2.0]heptane
CID 123439603
(2S)-1,1,2-trimethylcyclobutane
CID 59954523
(3R)-7-ethyl-3-methylspiro[3.5]nonane
CID 163822270
1-(2-methylbutan-2-yl)cycloheptan-1-amine
CID 90700569
1,1-dibromo-2-methylcyclobutane
CID 118387031
4-methyl-4-(2-methylbutan-2-yl)piperidine
CID 90425347
1-(2-methylbutan-2-yl)cyclohexane-1-carbonyl chloride
CID 54373319
1-(aminomethyl)-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclopentan-1-amine
CID 65045429
5,5-bis(3-ethylpentan-3-ylperoxy)-1,1,2-trimethylcyclohexane
CID 101294788
5,8-dimethylspiro[3.4]octane;propane
CID 90899958
1,3-dimethyl-1-(2-methylpentan-2-yl)cyclopentane
CID 123191359
1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol
CID 79125565

Frequently Asked Questions

What is the IUPAC name of 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane?
The IUPAC name of 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane (CID 91105645) is 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane.
What is the SMILES notation for 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane?
The canonical SMILES for 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane is [CH2-]C1(C(C)(C)CC)CCC1C.
What is the InChIKey of 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane?
The InChIKey is WADZLQHCMVMBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21/c1-6-10(3,4)11(5)8-7-9(11)2/h9H,5-8H2,1-4H3/q-1.
What are the key properties of 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane?
1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane has a molecular weight of 153.29 g/mol, XLogP of 3.67, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methanidyl-2-methyl-1-(2-methylbutan-2-yl)cyclobutane is sourced from PubChem (CID 91105645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).