1-cyclopropyl-1-ethyl-2-methylcyclopropane

C9H16 — CID 22389706

IUPAC1-cyclopropyl-1-ethyl-2-methylcyclopropane
SMILESCCC1(C2CC2)CC1C
InChIInChI=1S/C9H16/c1-3-9(6-7(9)2)8-4-5-8/h7-8H,3-6H2,1-2H3
InChIKeyXMJQMQMQMWMHGT-UHFFFAOYSA-N
MW124.23 g/mol
LogP2.83
Rot. Bonds2

About 1-cyclopropyl-1-ethyl-2-methylcyclopropane

1-cyclopropyl-1-ethyl-2-methylcyclopropane (PubChem CID 22389706) has the molecular formula C9H16 and a molecular weight of 124.23 g/mol. Its IUPAC name is 1-cyclopropyl-1-ethyl-2-methylcyclopropane.

Molecular Properties

Compound Name1-cyclopropyl-1-ethyl-2-methylcyclopropane
PubChem CID22389706
Molecular FormulaC9H16
Molecular Weight124.23 g/mol
Exact Mass124.13
IUPAC Name1-cyclopropyl-1-ethyl-2-methylcyclopropane
SMILESCCC1(C2CC2)CC1C
InChIInChI=1S/C9H16/c1-3-9(6-7(9)2)8-4-5-8/h7-8H,3-6H2,1-2H3
InChIKeyXMJQMQMQMWMHGT-UHFFFAOYSA-N
XLogP2.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.23
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-cyclopropyl-1-ethyl-2-methylcyclopropane 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-cyclopropyl-1,2-diethylcyclopropane
CID 123652648
1-cycloprop-2-en-1-yl-1-ethyl-2-methylcyclopropane
CID 123542377
4-cyclopropyl-4-ethyl-3-methylpiperidine
CID 79320206
1-ethyl-3-(1-ethyl-2-methylcyclopropyl)bicyclo[2.1.0]pentane
CID 123146097
1-cyclopropylbicyclo[1.1.0]butane
CID 123925920
(1R)-1-ethyl-1,2-dimethylcyclopropane
CID 177128711
1-ethyl-1,2-dimethylcyclopropane
CID 524629
2-(1,2-dimethylcyclobutyl)-1-ethylbicyclo[1.1.0]butane
CID 90876004
1,5-diethyl-1,3,5,7-tetramethylcyclooctane
CID 158662889
(1R,3aR,5S,6R,7aR)-7a-ethyl-1,4,4-trimethyl-2,3,3a,5,6,7-hexahydro-1H-indene-5,6-diol
CID 129073791
1-ethyl-1,2,5-trimethylcyclohexane
CID 123642131
7-methyltricyclo[4.3.0.01,3]nonane
CID 123597135

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-ethyl-2-methylcyclopropane?
The IUPAC name of 1-cyclopropyl-1-ethyl-2-methylcyclopropane (CID 22389706) is 1-cyclopropyl-1-ethyl-2-methylcyclopropane.
What is the SMILES notation for 1-cyclopropyl-1-ethyl-2-methylcyclopropane?
The canonical SMILES for 1-cyclopropyl-1-ethyl-2-methylcyclopropane is CCC1(C2CC2)CC1C.
What is the InChIKey of 1-cyclopropyl-1-ethyl-2-methylcyclopropane?
The InChIKey is XMJQMQMQMWMHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16/c1-3-9(6-7(9)2)8-4-5-8/h7-8H,3-6H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-ethyl-2-methylcyclopropane?
1-cyclopropyl-1-ethyl-2-methylcyclopropane has a molecular weight of 124.23 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-ethyl-2-methylcyclopropane is sourced from PubChem (CID 22389706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).