2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene

C14H26 — CID 22886811

IUPAC2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
SMILESCCCC1CCC2CC(C)CCC2C1
InChIInChI=1S/C14H26/c1-3-4-12-6-8-13-9-11(2)5-7-14(13)10-12/h11-14H,3-10H2,1-2H3
InChIKeyPIBICZXMTIHFIL-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.64
Rot. Bonds2

About 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene

2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene (PubChem CID 22886811) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene.

Molecular Properties

Compound Name2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
PubChem CID22886811
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
SMILESCCCC1CCC2CC(C)CCC2C1
InChIInChI=1S/C14H26/c1-3-4-12-6-8-13-9-11(2)5-7-14(13)10-12/h11-14H,3-10H2,1-2H3
InChIKeyPIBICZXMTIHFIL-UHFFFAOYSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-propylbicyclo[4.2.0]octane
CID 145186098
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
cis-(1R,3S)-1-methyl-3-propylcyclopentane
CID 59954450
1,3,6-trimethyl-9-propylcycloundecane
CID 123524783
1-methyl-4-(4-propylcyclohexyl)cyclohexane
CID 543958
2-[(E)-pent-3-enyl]-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 139866166
cis-(1R,3S)-1-methyl-3-propylcyclohexane
CID 154071124
(2R,4aR,6S)-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carbaldehyde
CID 18603493
(2R,4aR,6S)-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carbonitrile
CID 18603491
2-(4-propylcyclohexyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 22382934
(2R,4aR)-2-hexyl-6-pentyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 54489022
3-propylbicyclo[5.1.0]octane
CID 123651402

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene?
The IUPAC name of 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene (CID 22886811) is 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene.
What is the SMILES notation for 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene?
The canonical SMILES for 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene is CCCC1CCC2CC(C)CCC2C1.
What is the InChIKey of 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene?
The InChIKey is PIBICZXMTIHFIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-3-4-12-6-8-13-9-11(2)5-7-14(13)10-12/h11-14H,3-10H2,1-2H3.
What are the key properties of 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene?
2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene has a molecular weight of 194.36 g/mol, XLogP of 4.64, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene is sourced from PubChem (CID 22886811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).