1-(1-methylcyclopropyl)-3-propylcyclopentane

C12H22 — CID 163768039

IUPAC1-(1-methylcyclopropyl)-3-propylcyclopentane
SMILESCCCC1CCC(C2(C)CC2)C1
InChIInChI=1S/C12H22/c1-3-4-10-5-6-11(9-10)12(2)7-8-12/h10-11H,3-9H2,1-2H3
InChIKeyMEAQTAADIXDZDQ-UHFFFAOYSA-N
MW166.31 g/mol
LogP4.00
Rot. Bonds3

About 1-(1-methylcyclopropyl)-3-propylcyclopentane

1-(1-methylcyclopropyl)-3-propylcyclopentane (PubChem CID 163768039) has the molecular formula C12H22 and a molecular weight of 166.31 g/mol. Its IUPAC name is 1-(1-methylcyclopropyl)-3-propylcyclopentane.

Molecular Properties

Compound Name1-(1-methylcyclopropyl)-3-propylcyclopentane
PubChem CID163768039
Molecular FormulaC12H22
Molecular Weight166.31 g/mol
Exact Mass166.17
IUPAC Name1-(1-methylcyclopropyl)-3-propylcyclopentane
SMILESCCCC1CCC(C2(C)CC2)C1
InChIInChI=1S/C12H22/c1-3-4-10-5-6-11(9-10)12(2)7-8-12/h10-11H,3-9H2,1-2H3
InChIKeyMEAQTAADIXDZDQ-UHFFFAOYSA-N
XLogP4.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.31
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,6-dipropyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalene-4a-carbonitrile
CID 23311884
2,6-dipropyl-2,3,4,5,6,7,8,8a-octahydro-1H-naphthalene-4a-carboxylic acid
CID 23311783
cis-(1R,3S)-1-methyl-3-propylcyclopentane
CID 59954450
1,1-bis(4-propylcyclohexyl)cyclohexane
CID 54232179
3-propylbicyclo[4.2.0]octane
CID 145186098
1-ethyl-1-(4-propylcyclohexyl)cyclohexane
CID 57009275
1-(iodomethyl)-3-propylcyclopentane
CID 148554374
(3-propylcyclopentyl)methanamine
CID 83635339
2-propyl-6-[4-(6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)cyclohexyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 139866438
ethane;propane;propylcyclopropane
CID 145406182
1-(4-ethylcyclohexyl)-4-propylcyclohexan-1-amine
CID 64750303
2,4-dipropylcyclohexane-1,1-diamine
CID 22921284

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclopropyl)-3-propylcyclopentane?
The IUPAC name of 1-(1-methylcyclopropyl)-3-propylcyclopentane (CID 163768039) is 1-(1-methylcyclopropyl)-3-propylcyclopentane.
What is the SMILES notation for 1-(1-methylcyclopropyl)-3-propylcyclopentane?
The canonical SMILES for 1-(1-methylcyclopropyl)-3-propylcyclopentane is CCCC1CCC(C2(C)CC2)C1.
What is the InChIKey of 1-(1-methylcyclopropyl)-3-propylcyclopentane?
The InChIKey is MEAQTAADIXDZDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22/c1-3-4-10-5-6-11(9-10)12(2)7-8-12/h10-11H,3-9H2,1-2H3.
What are the key properties of 1-(1-methylcyclopropyl)-3-propylcyclopentane?
1-(1-methylcyclopropyl)-3-propylcyclopentane has a molecular weight of 166.31 g/mol, XLogP of 4.00, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclopropyl)-3-propylcyclopentane is sourced from PubChem (CID 163768039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).