1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane

C11H20 — CID 123608958

IUPAC1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane
SMILESCCC12CC1C(C)C2C(C)C
InChIInChI=1S/C11H20/c1-5-11-6-9(11)8(4)10(11)7(2)3/h7-10H,5-6H2,1-4H3
InChIKeyWNQWLNWWXNCRCN-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.32
Rot. Bonds2

About 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane

1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane (PubChem CID 123608958) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane.

Molecular Properties

Compound Name1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane
PubChem CID123608958
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane
SMILESCCC12CC1C(C)C2C(C)C
InChIInChI=1S/C11H20/c1-5-11-6-9(11)8(4)10(11)7(2)3/h7-10H,5-6H2,1-4H3
InChIKeyWNQWLNWWXNCRCN-UHFFFAOYSA-N
XLogP3.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane 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

4-ethyl-2-methyl-3-propan-2-yl-2-azabicyclo[2.1.0]pentane
CID 139469446
1-ethyl-3-(1-ethyl-2-methylcyclopropyl)bicyclo[2.1.0]pentane
CID 123146097
1-(1-cyclobutylethyl)-1-ethyl-2,3-dimethyl-4-propan-2-ylcyclobutane
CID 143367935
1-cyclopropyl-1-ethyl-2-methylcyclopropane
CID 22389706
1,1-diethyl-3-propan-2-ylcyclobutane
CID 162172993
1-ethyltricyclo[2.2.1.02,6]heptane
CID 12951260
2-(1,2-dimethylcyclobutyl)-1-ethylbicyclo[1.1.0]butane
CID 90876004
1-ethyl-1,2-di(propan-2-yl)cyclopropane
CID 140630902
1-cycloprop-2-en-1-yl-1-ethyl-2-methylcyclopropane
CID 123542377
1-ethyl-1-methyl-2-propan-2-ylcyclopropane
CID 91445155
2,3-dimethyl-6a-pentan-2-yl-1-propan-2-yl-2,3,3a,4,5,6-hexahydro-1H-pentalene
CID 23571929
(3R,5R,8R,9S,10S,13R,14S)-10-ethyl-17-(1-hydroxyethyl)-3,13,14-trimethyl-2,4,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
CID 170287580

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane?
The IUPAC name of 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane (CID 123608958) is 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane.
What is the SMILES notation for 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane?
The canonical SMILES for 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane is CCC12CC1C(C)C2C(C)C.
What is the InChIKey of 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane?
The InChIKey is WNQWLNWWXNCRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-5-11-6-9(11)8(4)10(11)7(2)3/h7-10H,5-6H2,1-4H3.
What are the key properties of 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane?
1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane has a molecular weight of 152.28 g/mol, XLogP of 3.32, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-2-propan-2-ylbicyclo[2.1.0]pentane is sourced from PubChem (CID 123608958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).