2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol

C17H24N4O3 — CID 110013550

IUPAC2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol
SMILESCCc1noc(C2CCC(Nc3ccc(OCCO)nc3)CC2)n1
InChIInChI=1S/C17H24N4O3/c1-2-15-20-17(24-21-15)12-3-5-13(6-4-12)19-14-7-8-16(18-11-14)23-10-9-22/h7-8,11-13,19,22H,2-6,9-10H2,1H3
InChIKeyNCPSUDFGJFADIL-UHFFFAOYSA-N
MW332.40 g/mol
LogP2.54
Rot. Bonds7

About 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol

2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol (PubChem CID 110013550) has the molecular formula C17H24N4O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol.

Molecular Properties

Compound Name2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol
PubChem CID110013550
Molecular FormulaC17H24N4O3
Molecular Weight332.40 g/mol
Exact Mass332.18
IUPAC Name2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol
SMILESCCc1noc(C2CCC(Nc3ccc(OCCO)nc3)CC2)n1
InChIInChI=1S/C17H24N4O3/c1-2-15-20-17(24-21-15)12-3-5-13(6-4-12)19-14-7-8-16(18-11-14)23-10-9-22/h7-8,11-13,19,22H,2-6,9-10H2,1H3
InChIKeyNCPSUDFGJFADIL-UHFFFAOYSA-N
XLogP2.54
TPSA93.30 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol with MolForge

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Related Compounds

2-[[6-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-3-pyridinyl]-methylamino]ethanol
CID 110013500
2-[[5-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]-2-pyridinyl]oxy]ethanol
CID 110011644
5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one
CID 154755113
[2-[[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]methyl]phenyl]methanol
CID 110013138
3-[[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]methyl]pentan-1-ol
CID 110013337
3-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-4-methylsulfanylbutan-1-ol
CID 110012282
4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine
CID 60812048
1-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-1-ethyl-3-(6-methoxy-3-pyridinyl)urea
CID 118760709
6-[[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]methyl]pyridine-3-carbonitrile
CID 138042647
[2-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methylcyclopentyl]methanol
CID 75473258
N-methyl-4-[3-(propoxymethyl)-1,2,4-oxadiazol-5-yl]cyclohexan-1-amine
CID 55202433
N-[4-[3-(2-ethylsulfonylethyl)-1,2,4-oxadiazol-5-yl]cyclohexyl]pyrazin-2-amine
CID 167940569

Frequently Asked Questions

What is the IUPAC name of 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol?
The IUPAC name of 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol (CID 110013550) is 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol.
What is the SMILES notation for 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol?
The canonical SMILES for 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol is CCc1noc(C2CCC(Nc3ccc(OCCO)nc3)CC2)n1.
What is the InChIKey of 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol?
The InChIKey is NCPSUDFGJFADIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O3/c1-2-15-20-17(24-21-15)12-3-5-13(6-4-12)19-14-7-8-16(18-11-14)23-10-9-22/h7-8,11-13,19,22H,2-6,9-10H2,1H3.
What are the key properties of 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol?
2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol has a molecular weight of 332.40 g/mol, XLogP of 2.54, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol is sourced from PubChem (CID 110013550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).