4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane

C12H20 — CID 123510764

IUPAC4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane
SMILESCCCC1C23CC2(C)C13C(C)C
InChIInChI=1S/C12H20/c1-5-6-9-11-7-10(11,4)12(9,11)8(2)3/h8-9H,5-7H2,1-4H3
InChIKeyWOOPBQFVHZLYCB-UHFFFAOYSA-N
MW164.29 g/mol
LogP3.47
Rot. Bonds3

About 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane

4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane (PubChem CID 123510764) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane.

Molecular Properties

Compound Name4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane
PubChem CID123510764
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane
SMILESCCCC1C23CC2(C)C13C(C)C
InChIInChI=1S/C12H20/c1-5-6-9-11-7-10(11,4)12(9,11)8(2)3/h8-9H,5-7H2,1-4H3
InChIKeyWOOPBQFVHZLYCB-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-1-propan-2-yl-3-propylcyclobutane
CID 91462890
3-(1-propan-2-yl-2-propylcyclopropyl)butan-2-one
CID 165006917
2-ethyl-1-methyl-1-propan-2-yl-3-propylcyclopropane
CID 123845526
1-butan-2-yl-1,2-dimethyl-3-propylcyclobutane
CID 123430128
1-ethyl-1-methyl-2-propylcyclopropane
CID 72514753
(1R)-1-[(2S,3S)-2-methyl-3-propyloxiran-2-yl]ethanol
CID 131106246
N-[1-(1-methylcyclopropyl)ethyl]-2-propylcyclopropan-1-amine
CID 115892173
2-amino-4-ethyl-1,4,6,6-tetramethyl-3-propylcyclooctan-1-ol
CID 123796456
2-ethyl-1,1,3-trimethyl-3-propan-2-ylcyclohexane
CID 144667532
1,1-dimethyl-3-propylcyclobutane
CID 19073360
1,1-dibromo-2-propylcyclopropane
CID 13198577
[(2S,3R)-2-methyl-3-propyloxiran-2-yl]methanol
CID 14959485

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane?
The IUPAC name of 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane (CID 123510764) is 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane.
What is the SMILES notation for 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane?
The canonical SMILES for 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane is CCCC1C23CC2(C)C13C(C)C.
What is the InChIKey of 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane?
The InChIKey is WOOPBQFVHZLYCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20/c1-5-6-9-11-7-10(11,4)12(9,11)8(2)3/h8-9H,5-7H2,1-4H3.
What are the key properties of 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane?
4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane has a molecular weight of 164.29 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-propan-2-yl-2-propyltricyclo[2.1.0.01,3]pentane is sourced from PubChem (CID 123510764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).