2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol

C14H25N3O2 — CID 74249979

IUPAC2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol
SMILESCC(C)OC(C)c1nc(C2CCCC2)nn1CCO
InChIInChI=1S/C14H25N3O2/c1-10(2)19-11(3)14-15-13(12-6-4-5-7-12)16-17(14)8-9-18/h10-12,18H,4-9H2,1-3H3
InChIKeySQCKRLUYZLROKA-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.41
Rot. Bonds6

About 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol

2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol (PubChem CID 74249979) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol
PubChem CID74249979
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol
SMILESCC(C)OC(C)c1nc(C2CCCC2)nn1CCO
InChIInChI=1S/C14H25N3O2/c1-10(2)19-11(3)14-15-13(12-6-4-5-7-12)16-17(14)8-9-18/h10-12,18H,4-9H2,1-3H3
InChIKeySQCKRLUYZLROKA-UHFFFAOYSA-N
XLogP2.41
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol with MolForge

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Related Compounds

2-[3-cyclopentyl-5-(tetrahydrofuran-3-yl)-1H-1,2,4-triazol-1-yl]ethanol
CID 72867529
1-butyl-3-cyclopentyl-5-[(2R)-1,4-dioxan-2-yl]-1,2,4-triazole
CID 97436385
(1S)-1-[5-tert-butyl-2-(2-hydroxyethyl)-1,2,4-triazol-3-yl]-3-methylbutan-1-ol
CID 97452955
5-cyclopentyl-1-[[(2S)-1,4-dioxan-2-yl]methyl]-3-methyl-1,2,4-triazole
CID 125526210
5-(1,4-dioxan-2-yl)-N-(2-methoxyethyl)-N-methyl-4-[(3-methylcyclopentyl)methyl]-1,2,4-triazol-3-amine
CID 132322642
[5-(3,3-Difluorocyclopentyl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]methanol
CID 114226800
[5-(3,3-Difluorocyclopentyl)-4-propyl-1,2,4-triazol-3-yl]methanol
CID 114226805
5-cyclopentyl-3-(methoxymethyl)-1-(2,2,2-trifluoroethyl)-1H-1,2,4-triazole
CID 138387757
3-(1-Ethoxy-2-methylpropyl)-1,5-dimethyl-1,2,4-triazole
CID 177332244
2-(5-Cyclopentyl-2-methyl-1,2,4-triazol-3-yl)morpholine
CID 62722881
Ethyl 5-cyclopentyl-2-methyl-1,2,4-triazole-3-carboxylate
CID 63355719
Ethyl 5-cyclopentyl-1-methyl-1,2,4-triazole-3-carboxylate
CID 63382209

Frequently Asked Questions

What is the IUPAC name of 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol?
The IUPAC name of 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol (CID 74249979) is 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol.
What is the SMILES notation for 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol?
The canonical SMILES for 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol is CC(C)OC(C)c1nc(C2CCCC2)nn1CCO.
What is the InChIKey of 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol?
The InChIKey is SQCKRLUYZLROKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-10(2)19-11(3)14-15-13(12-6-4-5-7-12)16-17(14)8-9-18/h10-12,18H,4-9H2,1-3H3.
What are the key properties of 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol?
2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol has a molecular weight of 267.37 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-cyclopentyl-5-(1-propan-2-yloxyethyl)-1,2,4-triazol-1-yl]ethanol is sourced from PubChem (CID 74249979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).