1-ethyl-1-methyl-2-propan-2-ylcyclopropane

C9H18 — CID 91445155

IUPAC1-ethyl-1-methyl-2-propan-2-ylcyclopropane
SMILESCCC1(C)CC1C(C)C
InChIInChI=1S/C9H18/c1-5-9(4)6-8(9)7(2)3/h7-8H,5-6H2,1-4H3
InChIKeyIPAGBUSEOGPFFR-UHFFFAOYSA-N
MW126.24 g/mol
LogP3.08
Rot. Bonds2

About 1-ethyl-1-methyl-2-propan-2-ylcyclopropane

1-ethyl-1-methyl-2-propan-2-ylcyclopropane (PubChem CID 91445155) has the molecular formula C9H18 and a molecular weight of 126.24 g/mol. Its IUPAC name is 1-ethyl-1-methyl-2-propan-2-ylcyclopropane.

Molecular Properties

Compound Name1-ethyl-1-methyl-2-propan-2-ylcyclopropane
PubChem CID91445155
Molecular FormulaC9H18
Molecular Weight126.24 g/mol
Exact Mass126.14
IUPAC Name1-ethyl-1-methyl-2-propan-2-ylcyclopropane
SMILESCCC1(C)CC1C(C)C
InChIInChI=1S/C9H18/c1-5-9(4)6-8(9)7(2)3/h7-8H,5-6H2,1-4H3
InChIKeyIPAGBUSEOGPFFR-UHFFFAOYSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.24
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-butyl-1-methyl-2-propan-2-ylcyclopropane
CID 91325328
1-ethyl-1,2-di(propan-2-yl)cyclopropane
CID 140630902
1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane
CID 123763181
1-but-1-ynyl-1-methyl-2-propan-2-ylcyclopropane
CID 123938589
(1R)-1-ethyl-1,2-dimethylcyclopropane
CID 177128711
1-ethyl-1,2-dimethylcyclopropane
CID 524629
1-ethyl-1-methyl-2-(2,2,5-trimethylnonan-4-yl)cyclopropane
CID 123760958
2-ethyl-2-methylcyclopropan-1-amine
CID 62389905
(1R)-1-[(1R,2R)-2-butyl-2-methylcyclopropyl]-2-methylpropan-1-ol
CID 102319002
(2-ethyl-2-methylcyclopropyl)-dimethyl-propan-2-ylazanium
CID 123487825
1-ethyl-2-propan-2-yl-1-(trifluoromethyl)cyclopropane
CID 121274010
1-methyl-2-propan-2-yl-1-propylcyclobutane
CID 123382647

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-methyl-2-propan-2-ylcyclopropane?
The IUPAC name of 1-ethyl-1-methyl-2-propan-2-ylcyclopropane (CID 91445155) is 1-ethyl-1-methyl-2-propan-2-ylcyclopropane.
What is the SMILES notation for 1-ethyl-1-methyl-2-propan-2-ylcyclopropane?
The canonical SMILES for 1-ethyl-1-methyl-2-propan-2-ylcyclopropane is CCC1(C)CC1C(C)C.
What is the InChIKey of 1-ethyl-1-methyl-2-propan-2-ylcyclopropane?
The InChIKey is IPAGBUSEOGPFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18/c1-5-9(4)6-8(9)7(2)3/h7-8H,5-6H2,1-4H3.
What are the key properties of 1-ethyl-1-methyl-2-propan-2-ylcyclopropane?
1-ethyl-1-methyl-2-propan-2-ylcyclopropane has a molecular weight of 126.24 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-methyl-2-propan-2-ylcyclopropane is sourced from PubChem (CID 91445155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).