potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane

C20H35KO2 — CID 142046655

IUPACpotassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane
SMILESC1CCC1.C1CCCC1.O=C([O-])C1CCC2CCCCC2C1.[K+]
InChIInChI=1S/C11H18O2.C5H10.C4H8.K/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;1-2-4-5-3-1;1-2-4-3-1;/h8-10H,1-7H2,(H,12,13);1-5H2;1-4H2;/q;;;+1/p-1
InChIKeyDRYMFGSLIUASNZ-UHFFFAOYSA-M
MW346.60 g/mol
LogP1.86
Rot. Bonds1

About potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane

potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane (PubChem CID 142046655) has the molecular formula C20H35KO2 and a molecular weight of 346.60 g/mol. Its IUPAC name is potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane.

Molecular Properties

Compound Namepotassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane
PubChem CID142046655
Molecular FormulaC20H35KO2
Molecular Weight346.60 g/mol
Exact Mass346.23
IUPAC Namepotassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane
SMILESC1CCC1.C1CCCC1.O=C([O-])C1CCC2CCCCC2C1.[K+]
InChIInChI=1S/C11H18O2.C5H10.C4H8.K/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;1-2-4-5-3-1;1-2-4-3-1;/h8-10H,1-7H2,(H,12,13);1-5H2;1-4H2;/q;;;+1/p-1
InChIKeyDRYMFGSLIUASNZ-UHFFFAOYSA-M
XLogP1.86
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.60
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R,4aR,9aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene-3-carboxylic acid
CID 131049059
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl(cyclohexyl)methanone
CID 114962205
cyclotetradecanecarboxylate
CID 140590492
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylic acid;acetic acid
CID 175499528
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)propan-1-one
CID 114962133
cyclohexyl-(4-cyclopentylcyclohexyl)methanone
CID 141495223
tris(cyclohexanecarboxylate);neodymium(3+)
CID 21259897
cycloheptanecarboxylate;thallium(1+)
CID 22604442
CID 171703364
CID 171703364
bis(cyclohexanecarboxylate);indium(3+);chloride
CID 160994257
calcium cyclohexane-1,3-dicarboxylate
CID 140879538
4-[3-(4-carboxycyclohexyl)cyclohexyl]cyclohexane-1-carboxylic acid
CID 22445971

Frequently Asked Questions

What is the IUPAC name of potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane?
The IUPAC name of potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane (CID 142046655) is potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane.
What is the SMILES notation for potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane?
The canonical SMILES for potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane is C1CCC1.C1CCCC1.O=C([O-])C1CCC2CCCCC2C1.[K+].
What is the InChIKey of potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane?
The InChIKey is DRYMFGSLIUASNZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C11H18O2.C5H10.C4H8.K/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;1-2-4-5-3-1;1-2-4-3-1;/h8-10H,1-7H2,(H,12,13);1-5H2;1-4H2;/q;;;+1/p-1.
What are the key properties of potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane?
potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane has a molecular weight of 346.60 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxylate;cyclobutane;cyclopentane is sourced from PubChem (CID 142046655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).