1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane

C20H32 — CID 158506578

IUPAC1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane
SMILESCCCCC.c1ccc2c(c1)CCCC2C1CCCC1
InChIInChI=1S/C15H20.C5H12/c1-2-7-12(6-1)15-11-5-9-13-8-3-4-10-14(13)15;1-3-5-4-2/h3-4,8,10,12,15H,1-2,5-7,9,11H2;3-5H2,1-2H3
InChIKeyHKNOLLJSNPGKAS-UHFFFAOYSA-N
MW272.48 g/mol
LogP6.49
Rot. Bonds3

About 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane

1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane (PubChem CID 158506578) has the molecular formula C20H32 and a molecular weight of 272.48 g/mol. Its IUPAC name is 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane.

Molecular Properties

Compound Name1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane
PubChem CID158506578
Molecular FormulaC20H32
Molecular Weight272.48 g/mol
Exact Mass272.25
IUPAC Name1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane
SMILESCCCCC.c1ccc2c(c1)CCCC2C1CCCC1
InChIInChI=1S/C15H20.C5H12/c1-2-7-12(6-1)15-11-5-9-13-8-3-4-10-14(13)15;1-3-5-4-2/h3-4,8,10,12,15H,1-2,5-7,9,11H2;3-5H2,1-2H3
InChIKeyHKNOLLJSNPGKAS-UHFFFAOYSA-N
XLogP6.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.48
LogP ≤ 56.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 141010312
2,3,4,4a,9,9a-hexahydro-1H-fluorene
CID 519137
5-pentyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 58420594
1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene
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1,2,3,3a,4,8b-hexahydrocyclopenta[a]indene;ethane
CID 91488349
3-butyl-2,4,4a,5,6,10b-hexahydro-1H-benzo[f]isoquinoline
CID 19093629
1-icosan-8-yl-1,2,3,4-tetrahydronaphthalene
CID 175494887
1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene
CID 123892030
1-(6-methylundecan-6-yl)-1,2,3,4-tetrahydronaphthalene
CID 142140914
(1S,2S)-2-cyclopentyl-1-propyl-1,2,3,4-tetrahydronaphthalene
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6-butyl-N-ethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63403512

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane?
The IUPAC name of 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane (CID 158506578) is 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane.
What is the SMILES notation for 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane?
The canonical SMILES for 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane is CCCCC.c1ccc2c(c1)CCCC2C1CCCC1.
What is the InChIKey of 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane?
The InChIKey is HKNOLLJSNPGKAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20.C5H12/c1-2-7-12(6-1)15-11-5-9-13-8-3-4-10-14(13)15;1-3-5-4-2/h3-4,8,10,12,15H,1-2,5-7,9,11H2;3-5H2,1-2H3.
What are the key properties of 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane?
1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane has a molecular weight of 272.48 g/mol, XLogP of 6.49, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane is sourced from PubChem (CID 158506578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).