2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]

C12H20 — CID 163943530

IUPAC2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]
SMILESCCCC1C2CC3(CC12)CC3C
InChIInChI=1S/C12H20/c1-3-4-9-10-6-12(5-8(12)2)7-11(9)10/h8-11H,3-7H2,1-2H3
InChIKeyRTCWDEHKJFXHMU-UHFFFAOYSA-N
MW164.29 g/mol
LogP3.47
Rot. Bonds2

About 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]

2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane] (PubChem CID 163943530) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane].

Molecular Properties

Compound Name2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]
PubChem CID163943530
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]
SMILESCCCC1C2CC3(CC12)CC3C
InChIInChI=1S/C12H20/c1-3-4-9-10-6-12(5-8(12)2)7-11(9)10/h8-11H,3-7H2,1-2H3
InChIKeyRTCWDEHKJFXHMU-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
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

Analyze 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane] with MolForge

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Related Compounds

1-methyl-9-propylpentacyclo[6.3.2.02,7.04,10.05,12]tridecane
CID 123564326
3-methyl-2,4-dipropylbicyclo[3.1.0]hexane
CID 21354381
6-propylbicyclo[3.1.0]hexan-3-one
CID 72536529
1,2,3,4-tetramethyl-5-propylcyclopentane
CID 23231337
1,2,3-trimethyl-4-propylcyclobutane
CID 90876457
(1R,2R,5S,6S)-2-methyl-6-propylbicyclo[3.1.0]hexane
CID 58708477
(2S)-2-methylspiro[2.2]pentane
CID 153461113
2-propylspiro[2.2]pentane
CID 549029
1,3-dimethyl-2-propylcycloheptane
CID 123611013
2,5-dimethyl-3-propylbicyclo[2.2.0]hexane
CID 91214227
9-propyl-2,3,4,4a,5,6,7,8,8a,9,9a,10a-dodecahydro-1H-thioxanthene
CID 12574118
1,2-dimethyl-4-propylbicyclo[1.1.1]pentane
CID 91437599

Frequently Asked Questions

What is the IUPAC name of 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]?
The IUPAC name of 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane] (CID 163943530) is 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane].
What is the SMILES notation for 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]?
The canonical SMILES for 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane] is CCCC1C2CC3(CC12)CC3C.
What is the InChIKey of 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]?
The InChIKey is RTCWDEHKJFXHMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20/c1-3-4-9-10-6-12(5-8(12)2)7-11(9)10/h8-11H,3-7H2,1-2H3.
What are the key properties of 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane]?
2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane] has a molecular weight of 164.29 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-methyl-6-propylspiro[bicyclo[3.1.0]hexane-3,1'-cyclopropane] is sourced from PubChem (CID 163943530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).