1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene

C17H24 — CID 139783545

IUPAC1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene
SMILESCC1(C)CC(C)(C)c2cc3c(cc21)CCCC3
InChIInChI=1S/C17H24/c1-16(2)11-17(3,4)15-10-13-8-6-5-7-12(13)9-14(15)16/h9-10H,5-8,11H2,1-4H3
InChIKeyHBIAXWVLEMLMRN-UHFFFAOYSA-N
MW228.38 g/mol
LogP4.52
Rot. Bonds

About 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene

1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene (PubChem CID 139783545) has the molecular formula C17H24 and a molecular weight of 228.38 g/mol. Its IUPAC name is 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene.

Molecular Properties

Compound Name1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene
PubChem CID139783545
Molecular FormulaC17H24
Molecular Weight228.38 g/mol
Exact Mass228.19
IUPAC Name1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene
SMILESCC1(C)CC(C)(C)c2cc3c(cc21)CCCC3
InChIInChI=1S/C17H24/c1-16(2)11-17(3,4)15-10-13-8-6-5-7-12(13)9-14(15)16/h9-10H,5-8,11H2,1-4H3
InChIKeyHBIAXWVLEMLMRN-UHFFFAOYSA-N
XLogP4.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1S)-3,3-dimethyl-1,2,5,6,7,8-hexahydrocyclopenta[b]naphthalen-1-ol
CID 115483220
(6R)-1,1,4,4-tetramethyl-3,6,7,8,9,10-hexahydro-2H-cyclohepta[b]naphthalen-6-ol
CID 104889645
6-(6-hydroxy-1,1,3,3-tetramethyl-2H-inden-5-yl)-1,1,3,3-tetramethyl-2H-inden-5-ol
CID 70523762
(1R)-3,3-dimethyl-2,5,6,7-tetrahydro-1H-s-indacen-1-amine
CID 115483155
5,5,7,7-tetramethyl-6H-cyclopenta[f]isoindole-1,3-dione
CID 58188493
2,3,4,5,7,8,9,10-octahydro-1H-benzo[h][3]benzazepine
CID 29078509
(2Z)-3-methyl-6-(1,1,3,3-tetramethyl-2,6,7,8-tetrahydrocyclopenta[g]naphthalen-5-ylidene)hexa-2,4-dienoic acid
CID 173297429
N,3,3-trimethyl-2,5,6,7-tetrahydro-1H-s-indacen-1-amine
CID 115483154
1,1,3,3-tetramethyl-N-(1,1,3,3-tetramethyl-2H-inden-5-yl)-2H-inden-5-amine
CID 154972054
9,9-dimethyl-2,7-bis(5,6,7,8-tetrahydronaphthalen-2-yl)fluorene
CID 59217252
1,1,3,3,8-pentamethyl-2,5,7,8-tetrahydrocyclopenta[b]naphthalen-6-one
CID 70485827
2,2'-spirobi[1,3,5,6,7,8-hexahydrocyclopenta[b]naphthalene]
CID 640520

Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene?
The IUPAC name of 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene (CID 139783545) is 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene.
What is the SMILES notation for 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene?
The canonical SMILES for 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene is CC1(C)CC(C)(C)c2cc3c(cc21)CCCC3.
What is the InChIKey of 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene?
The InChIKey is HBIAXWVLEMLMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24/c1-16(2)11-17(3,4)15-10-13-8-6-5-7-12(13)9-14(15)16/h9-10H,5-8,11H2,1-4H3.
What are the key properties of 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene?
1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene has a molecular weight of 228.38 g/mol, XLogP of 4.52, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3-tetramethyl-5,6,7,8-tetrahydro-2H-cyclopenta[b]naphthalene is sourced from PubChem (CID 139783545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).