N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide

C93H90F12N4O11 — CID 167641265

IUPACN-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide
SMILESCCCC(CCO)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CCC[C@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CC[C@@H](O)[C@@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CC[C@H](O)[C@@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1
InChIInChI=1S/C24H24F3NO3.2C23H22F3NO3.C23H22F3NO2/c1-2-4-19(13-14-29)28-23(30)17-7-12-21-16(15-17)5-3-6-22(21)31-20-10-8-18(9-11-20)24(25,26)27;2*1-3-20(28)14(2)27-22(29)16-7-12-19-15(13-16)5-4-6-21(19)30-18-10-8-17(9-11-18)23(24,25)26;1-3-5-15(2)27-22(28)17-8-13-20-16(14-17)6-4-7-21(20)29-19-11-9-18(10-12-19)23(24,25)26/h3,5-12,15,19,29H,2,4,13-14H2,1H3,(H,28,30);2*4-14,20,28H,3H2,1-2H3,(H,27,29);4,6-15H,3,5H2,1-2H3,(H,27,28)/t;14-,20+;14-,20-;15-/m.110/s1
InChIKeyPEQXFTWOQXYZTJ-DYFQNOBKSA-N
MW1667.74 g/mol
LogP23.58
Rot. Bonds26

About N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide

N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide (PubChem CID 167641265) has the molecular formula C93H90F12N4O11 and a molecular weight of 1667.74 g/mol. Its IUPAC name is N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide
PubChem CID167641265
Molecular FormulaC93H90F12N4O11
Molecular Weight1667.74 g/mol
Exact Mass1666.64
IUPAC NameN-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide
SMILESCCCC(CCO)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CCC[C@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CC[C@@H](O)[C@@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CC[C@H](O)[C@@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1
InChIInChI=1S/C24H24F3NO3.2C23H22F3NO3.C23H22F3NO2/c1-2-4-19(13-14-29)28-23(30)17-7-12-21-16(15-17)5-3-6-22(21)31-20-10-8-18(9-11-20)24(25,26)27;2*1-3-20(28)14(2)27-22(29)16-7-12-19-15(13-16)5-4-6-21(19)30-18-10-8-17(9-11-18)23(24,25)26;1-3-5-15(2)27-22(28)17-8-13-20-16(14-17)6-4-7-21(20)29-19-11-9-18(10-12-19)23(24,25)26/h3,5-12,15,19,29H,2,4,13-14H2,1H3,(H,28,30);2*4-14,20,28H,3H2,1-2H3,(H,27,29);4,6-15H,3,5H2,1-2H3,(H,27,28)/t;14-,20+;14-,20-;15-/m.110/s1
InChIKeyPEQXFTWOQXYZTJ-DYFQNOBKSA-N
XLogP23.58
TPSA214.01 Ų
H-Bond Donors7
H-Bond Acceptors11
Rotatable Bonds26
Heavy Atoms120
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001667.74
LogP ≤ 523.58
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1011

Analyze N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide with MolForge

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Related Compounds

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2-Naphthalenecarboxamide, N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-
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YAP/TAZ inhibitor-3
CID 155214091
3-(2-acetylphenyl)-5-ethoxy-N-[(2S,3R)-3-hydroxy-1-phenyl-4-({[3-(trifluoromethyl)phenyl]methyl}amino)butan-2-yl]benzamide
CID 25190483
3-(2-cyanophenyl)-5-ethoxy-N-[(2S,3R)-3-hydroxy-1-phenyl-4-({[3-(trifluoromethyl)phenyl]methyl}amino)butan-2-yl]benzamide
CID 25190484
(2S)-N-[(1S,2R)-1-benzyl-3-[2-(tert-butylcarbamoyl)phenoxy]-2-hydroxy-propyl]-2-[(9,10-dioxoanthracene-2-carbonyl)amino]butanediamide
CID 469364
(2S)-N-[(1S,2S)-1-benzyl-3-[2-(tert-butylcarbamoyl)phenoxy]-2-hydroxy-propyl]-2-[(9,10-dioxoanthracene-2-carbonyl)amino]butanediamide
CID 469365
(2S)-N-[(1S,2S)-1-benzyl-3-[[1-(tert-butylcarbamoyl)-2-naphthyl]oxy]-2-hydroxy-propyl]-2-[(9,10-dioxoanthracene-2-carbonyl)amino]butanediamide
CID 469367
CID 44532849
CID 44532849
N-[4-[4-[4-(2-amino-2-oxoethoxy)-2,5-dimethylphenyl]piperidin-1-yl]butyl]-4-[4-(trifluoromethyl)phenyl]benzamide
CID 44532892
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4'-Butoxy-3'-[4-(trifluoromethyl)-2-fluorobenzoylaminomethyl]-2-methyl-4-biphenylcarboxylic acid
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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide?
The IUPAC name of N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide (CID 167641265) is N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide.
What is the SMILES notation for N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide?
The canonical SMILES for N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide is CCCC(CCO)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CCC[C@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CC[C@@H](O)[C@@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.CC[C@H](O)[C@@H](C)NC(=O)c1ccc2c(Oc3ccc(C(F)(F)F)cc3)cccc2c1.
What is the InChIKey of N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide?
The InChIKey is PEQXFTWOQXYZTJ-DYFQNOBKSA-N. The full InChI is InChI=1S/C24H24F3NO3.2C23H22F3NO3.C23H22F3NO2/c1-2-4-19(13-14-29)28-23(30)17-7-12-21-16(15-17)5-3-6-22(21)31-20-10-8-18(9-11-20)24(25,26)27;2*1-3-20(28)14(2)27-22(29)16-7-12-19-15(13-16)5-4-6-21(19)30-18-10-8-17(9-11-18)23(24,25)26;1-3-5-15(2)27-22(28)17-8-13-20-16(14-17)6-4-7-21(20)29-19-11-9-18(10-12-19)23(24,25)26/h3,5-12,15,19,29H,2,4,13-14H2,1H3,(H,28,30);2*4-14,20,28H,3H2,1-2H3,(H,27,29);4,6-15H,3,5H2,1-2H3,(H,27,28)/t;14-,20+;14-,20-;15-/m.110/s1.
What are the key properties of N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide?
N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide has a molecular weight of 1667.74 g/mol, XLogP of 23.58, 26 rotatable bonds, 7 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxyhexan-3-yl)-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3R)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2R,3S)-3-hydroxypentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide;N-[(2S)-pentan-2-yl]-5-[4-(trifluoromethyl)phenoxy]naphthalene-2-carboxamide is sourced from PubChem (CID 167641265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).