2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol — IUPAC name, SMILES, InChIKey & properties

Name: 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol

2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol (PubChem CID 161352375) has the molecular formula C120H148F12O10 and a molecular weight of 1978.47 g/mol. Its IUPAC name is 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol.

Molecular Properties

Compound Name	2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol
PubChem CID	161352375
Molecular Formula	C120H148F12O10
Molecular Weight	1978.47 g/mol
Exact Mass	1977.09
IUPAC Name	2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol
SMILES	C=C(C)c1c(C2(OC(C)(C)C(C)(O)C(F)(F)F)CCCC2)ccc2ccccc12.C=C(C)c1cc(C2(OC(C)(C)C(C)(O)C(F)(F)F)CCCC2)c2ccccc2c1.C=C(C)c1cc(C2(OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F)CCCC2)cc2ccccc12.C=C(C)c1cc2ccccc2cc1C1(OC(C)(C)C(C)(C)O)CCCC1.C=C(C)c1cccc2cccc(C3(OC(C)(C)C(C)(C)O)CCCC3)c12
InChI	InChI=1S/C24H26F6O2.2C24H29F3O2.2C24H32O2/c1-15(2)19-14-17(13-16-9-5-6-10-18(16)19)21(11-7-8-12-21)32-20(3,4)22(31,23(25,26)27)24(28,29)30;1-16(2)20-18-11-7-6-10-17(18)12-13-19(20)23(14-8-9-15-23)29-21(3,4)22(5,28)24(25,26)27;1-16(2)18-14-17-10-6-7-11-19(17)20(15-18)23(12-8-9-13-23)29-21(3,4)22(5,28)24(25,26)27;1-17(2)19-13-9-11-18-12-10-14-20(21(18)19)24(15-7-8-16-24)26-23(5,6)22(3,4)25;1-17(2)20-15-18-11-7-8-12-19(18)16-21(20)24(13-9-10-14-24)26-23(5,6)22(3,4)25/h5-6,9-10,13-14,31H,1,7-8,11-12H2,2-4H3;6-7,10-13,28H,1,8-9,14-15H2,2-5H3;6-7,10-11,14-15,28H,1,8-9,12-13H2,2-5H3;9-14,25H,1,7-8,15-16H2,2-6H3;7-8,11-12,15-16,25H,1,9-10,13-14H2,2-6H3
InChIKey	VOBZNJANIBUOMR-UHFFFAOYSA-N
XLogP	33.21
TPSA	147.30 Å²
H-Bond Donors	5
H-Bond Acceptors	10
Rotatable Bonds	25
Heavy Atoms	142
Complexity	—

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1978.47
LogP ≤ 5	33.21
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	10

Analyze 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol?

The IUPAC name of 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol (CID 161352375) is 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol.

What is the SMILES notation for 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol?

The canonical SMILES for 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol is C=C(C)c1c(C2(OC(C)(C)C(C)(O)C(F)(F)F)CCCC2)ccc2ccccc12.C=C(C)c1cc(C2(OC(C)(C)C(C)(O)C(F)(F)F)CCCC2)c2ccccc2c1.C=C(C)c1cc(C2(OC(C)(C)C(O)(C(F)(F)F)C(F)(F)F)CCCC2)cc2ccccc12.C=C(C)c1cc2ccccc2cc1C1(OC(C)(C)C(C)(C)O)CCCC1.C=C(C)c1cccc2cccc(C3(OC(C)(C)C(C)(C)O)CCCC3)c12.

What is the InChIKey of 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol?

The InChIKey is VOBZNJANIBUOMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26F6O2.2C24H29F3O2.2C24H32O2/c1-15(2)19-14-17(13-16-9-5-6-10-18(16)19)21(11-7-8-12-21)32-20(3,4)22(31,23(25,26)27)24(28,29)30;1-16(2)20-18-11-7-6-10-17(18)12-13-19(20)23(14-8-9-15-23)29-21(3,4)22(5,28)24(25,26)27;1-16(2)18-14-17-10-6-7-11-19(17)20(15-18)23(12-8-9-13-23)29-21(3,4)22(5,28)24(25,26)27;1-17(2)19-13-9-11-18-12-10-14-20(21(18)19)24(15-7-8-16-24)26-23(5,6)22(3,4)25;1-17(2)20-15-18-11-7-8-12-19(18)16-21(20)24(13-9-10-14-24)26-23(5,6)22(3,4)25/h5-6,9-10,13-14,31H,1,7-8,11-12H2,2-4H3;6-7,10-13,28H,1,8-9,14-15H2,2-5H3;6-7,10-11,14-15,28H,1,8-9,12-13H2,2-5H3;9-14,25H,1,7-8,15-16H2,2-6H3;7-8,11-12,15-16,25H,1,9-10,13-14H2,2-6H3.

What are the key properties of 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol?

Where does this data come from?

All data for 2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;2,3-dimethyl-3-[1-(8-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(1-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-2,3-dimethyl-3-[1-(3-prop-1-en-2-ylnaphthalen-1-yl)cyclopentyl]oxybutan-2-ol;1,1,1-trifluoro-3-methyl-3-[1-(4-prop-1-en-2-ylnaphthalen-2-yl)cyclopentyl]oxy-2-(trifluoromethyl)butan-2-ol is sourced from PubChem (CID 161352375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).