(1R)-1-(1-propyltriazol-4-yl)ethanol

C7H13N3O — CID 130567201

IUPAC(1R)-1-(1-propyltriazol-4-yl)ethanol
SMILESCCCn1cc([C@@H](C)O)nn1
InChIInChI=1S/C7H13N3O/c1-3-4-10-5-7(6(2)11)8-9-10/h5-6,11H,3-4H2,1-2H3/t6-/m1/s1
InChIKeyQMOVTQSJAOEFSY-ZCFIWIBFSA-N
MW155.20 g/mol
LogP0.74
Rot. Bonds3

About (1R)-1-(1-propyltriazol-4-yl)ethanol

(1R)-1-(1-propyltriazol-4-yl)ethanol (PubChem CID 130567201) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is (1R)-1-(1-propyltriazol-4-yl)ethanol.

Molecular Properties

Compound Name(1R)-1-(1-propyltriazol-4-yl)ethanol
PubChem CID130567201
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name(1R)-1-(1-propyltriazol-4-yl)ethanol
SMILESCCCn1cc([C@@H](C)O)nn1
InChIInChI=1S/C7H13N3O/c1-3-4-10-5-7(6(2)11)8-9-10/h5-6,11H,3-4H2,1-2H3/t6-/m1/s1
InChIKeyQMOVTQSJAOEFSY-ZCFIWIBFSA-N
XLogP0.74
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-pentyltriazol-4-yl)ethanol
CID 81444188
3-methyl-1-(1-propyltriazol-4-yl)butan-1-ol
CID 145288458
1-[1-[2-(2-methylpropoxy)ethyl]triazol-4-yl]ethanol
CID 106456459
(1S)-1-[1-(2,2,2-trifluoroethyl)triazol-4-yl]ethanol
CID 130567367
1-[1-[(1-butyltetrazol-5-yl)methyl]triazol-4-yl]ethanol
CID 81445118
(1S)-1-[1-(cyclopropylmethyl)triazol-4-yl]ethanol
CID 130567336
1-[1-[(2,3,4,5,6-pentafluorophenyl)methyl]triazol-4-yl]ethanol
CID 81444296
1-[1-(2-phenoxyethyl)triazol-4-yl]ethanol
CID 81444678
(1S)-1-(1-benzyltriazol-4-yl)ethanol
CID 75176225
1,1,1-trifluoro-3-[4-(1-hydroxyethyl)triazol-1-yl]propan-2-ol
CID 81443893
3-[2-[4-(1-hydroxyethyl)triazol-1-yl]ethylsulfonyl]propanamide
CID 81445214
N,N-dibutyl-2-[4-(1-hydroxyethyl)triazol-1-yl]acetamide
CID 80742430

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(1-propyltriazol-4-yl)ethanol?
The IUPAC name of (1R)-1-(1-propyltriazol-4-yl)ethanol (CID 130567201) is (1R)-1-(1-propyltriazol-4-yl)ethanol.
What is the SMILES notation for (1R)-1-(1-propyltriazol-4-yl)ethanol?
The canonical SMILES for (1R)-1-(1-propyltriazol-4-yl)ethanol is CCCn1cc([C@@H](C)O)nn1.
What is the InChIKey of (1R)-1-(1-propyltriazol-4-yl)ethanol?
The InChIKey is QMOVTQSJAOEFSY-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H13N3O/c1-3-4-10-5-7(6(2)11)8-9-10/h5-6,11H,3-4H2,1-2H3/t6-/m1/s1.
What are the key properties of (1R)-1-(1-propyltriazol-4-yl)ethanol?
(1R)-1-(1-propyltriazol-4-yl)ethanol has a molecular weight of 155.20 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(1-propyltriazol-4-yl)ethanol is sourced from PubChem (CID 130567201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).