ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene

C15H20 — CID 143658716

IUPACethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene
SMILESC1=Cc2c(ccc3c2CCC3)CC1.CC
InChIInChI=1S/C13H14.C2H6/c1-2-6-12-10(4-1)8-9-11-5-3-7-13(11)12;1-2/h2,6,8-9H,1,3-5,7H2;1-2H3
InChIKeyJXCPLCHWWMGCHR-UHFFFAOYSA-N
MW200.32 g/mol
LogP4.16
Rot. Bonds

About ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene

ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene (PubChem CID 143658716) has the molecular formula C15H20 and a molecular weight of 200.32 g/mol. Its IUPAC name is ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene.

Molecular Properties

Compound Nameethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene
PubChem CID143658716
Molecular FormulaC15H20
Molecular Weight200.32 g/mol
Exact Mass200.16
IUPAC Nameethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene
SMILESC1=Cc2c(ccc3c2CCC3)CC1.CC
InChIInChI=1S/C13H14.C2H6/c1-2-6-12-10(4-1)8-9-11-5-3-7-13(11)12;1-2/h2,6,8-9H,1,3-5,7H2;1-2H3
InChIKeyJXCPLCHWWMGCHR-UHFFFAOYSA-N
XLogP4.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6-methyl-1,2-dihydrochrysene
CID 143566629
4-methyl-7,8-dihydroisoquinoline
CID 143321437
CID 175958969
CID 175958969
2-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4(9),5,10,13,15,17(22),20-nonaene
CID 129174545
1,2-dihydrophenanthrene;methane
CID 142233557
3-(7,8-dihydronaphthalen-2-yl)-5,6-dihydro-4H-cyclopenta[c]thiophene;ethane
CID 144904524
4-methyl-3-methylsulfanyl-8,9-dihydro-7H-benzo[7]annulene
CID 139885459
ethane;8-prop-1-en-2-yl-7-propyl-1,2-dihydrophenanthrene
CID 143675251
3,4-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene;ethane
CID 91587373
1-ethyl-5,6-dihydroisoquinoline
CID 174496014
4-methyl-7,8-dihydronaphthalen-2-ol
CID 177036097
(E)-N-[(E)-(2-methyl-5,6-dihydronaphthalen-1-yl)methylideneamino]-1-phenylethanimine
CID 174153049

Frequently Asked Questions

What is the IUPAC name of ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene?
The IUPAC name of ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene (CID 143658716) is ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene.
What is the SMILES notation for ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene?
The canonical SMILES for ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene is C1=Cc2c(ccc3c2CCC3)CC1.CC.
What is the InChIKey of ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene?
The InChIKey is JXCPLCHWWMGCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14.C2H6/c1-2-6-12-10(4-1)8-9-11-5-3-7-13(11)12;1-2/h2,6,8-9H,1,3-5,7H2;1-2H3.
What are the key properties of ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene?
ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene has a molecular weight of 200.32 g/mol, XLogP of 4.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,3,6,7-tetrahydro-1H-cyclopenta[a]naphthalene is sourced from PubChem (CID 143658716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).