1,2-dimethyl-1-propan-2-ylcyclopropane

C8H15- — CID 91248342

IUPAC1,2-dimethyl-1-propan-2-ylcyclopropane
SMILESC[C-](C)C1(C)CC1C
InChIInChI=1S/C8H15/c1-6(2)8(4)5-7(8)3/h7H,5H2,1-4H3/q-1
InChIKeyUGJBYDANIDRFPV-UHFFFAOYSA-N
MW111.21 g/mol
LogP2.65
Rot. Bonds1

About 1,2-dimethyl-1-propan-2-ylcyclopropane

1,2-dimethyl-1-propan-2-ylcyclopropane (PubChem CID 91248342) has the molecular formula C8H15- and a molecular weight of 111.21 g/mol. Its IUPAC name is 1,2-dimethyl-1-propan-2-ylcyclopropane.

Molecular Properties

Compound Name1,2-dimethyl-1-propan-2-ylcyclopropane
PubChem CID91248342
Molecular FormulaC8H15-
Molecular Weight111.21 g/mol
Exact Mass111.12
IUPAC Name1,2-dimethyl-1-propan-2-ylcyclopropane
SMILESC[C-](C)C1(C)CC1C
InChIInChI=1S/C8H15/c1-6(2)8(4)5-7(8)3/h7H,5H2,1-4H3/q-1
InChIKeyUGJBYDANIDRFPV-UHFFFAOYSA-N
XLogP2.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.21
LogP ≤ 52.65
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

(2S)-1,1,2-trimethylcyclopropane
CID 25022262
(2R)-1-fluoro-1,2-dimethylcyclopropane
CID 147738297
CID 162401464
CID 162401464
azane;1,1,2-trimethylcyclopropane;hydrochloride
CID 174915163
1-(1,2-dimethylcyclopropyl)oxy-1,2-dimethylcyclopropane
CID 175071290
2-methylcyclopropane-1,1-diol
CID 68932442
1-ethyl-1,2-dimethylcyclopropane
CID 524629
(1R)-1-ethyl-1,2-dimethylcyclopropane
CID 177128711
(2S)-2-methylspiro[2.2]pentane
CID 153461113
1,1,3-trimethylcyclobutane
CID 12656861
trans-(1S,2R)-1-dimethoxyphosphoryl-1,2-dimethylcyclopropane
CID 23268630
1,3,4,4,5-pentamethylpiperidine
CID 18740724

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-1-propan-2-ylcyclopropane?
The IUPAC name of 1,2-dimethyl-1-propan-2-ylcyclopropane (CID 91248342) is 1,2-dimethyl-1-propan-2-ylcyclopropane.
What is the SMILES notation for 1,2-dimethyl-1-propan-2-ylcyclopropane?
The canonical SMILES for 1,2-dimethyl-1-propan-2-ylcyclopropane is C[C-](C)C1(C)CC1C.
What is the InChIKey of 1,2-dimethyl-1-propan-2-ylcyclopropane?
The InChIKey is UGJBYDANIDRFPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15/c1-6(2)8(4)5-7(8)3/h7H,5H2,1-4H3/q-1.
What are the key properties of 1,2-dimethyl-1-propan-2-ylcyclopropane?
1,2-dimethyl-1-propan-2-ylcyclopropane has a molecular weight of 111.21 g/mol, XLogP of 2.65, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-1-propan-2-ylcyclopropane is sourced from PubChem (CID 91248342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).