2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol

C10H17N3O — CID 130555176

IUPAC2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol
SMILESCCCn1nncc1C1(O)CCC1C
InChIInChI=1S/C10H17N3O/c1-3-6-13-9(7-11-12-13)10(14)5-4-8(10)2/h7-8,14H,3-6H2,1-2H3
InChIKeyZYWMGXTYONHAGW-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.31
Rot. Bonds3

About 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol

2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol (PubChem CID 130555176) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol
PubChem CID130555176
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol
SMILESCCCn1nncc1C1(O)CCC1C
InChIInChI=1S/C10H17N3O/c1-3-6-13-9(7-11-12-13)10(14)5-4-8(10)2/h7-8,14H,3-6H2,1-2H3
InChIKeyZYWMGXTYONHAGW-UHFFFAOYSA-N
XLogP1.31
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol
CID 103564590
1-(3-propyltriazol-4-yl)cyclopentan-1-ol
CID 114684539
1-methyl-4-(3-propyltriazol-4-yl)piperidin-4-ol
CID 114684610
3-cyclopropyl-1-(3-propyltriazol-4-yl)cyclohexan-1-ol
CID 114685047
8-(3-propyltriazol-4-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 114685110
5-(3-bromo-1-methylcyclopentyl)-1-propyltriazole
CID 114690670
3-(3-ethyltriazol-4-yl)-2-methylthiolan-3-ol
CID 130484192
1-phenyl-4-(3-propyltriazol-4-yl)piperidin-4-ol
CID 106820939
5-(2-tert-butylpyrrolidin-2-yl)-1-propyltriazole
CID 114688277
1-(4-chloro-1-propylpyrazol-5-yl)-2-methylcyclopentan-1-ol
CID 114636173
4-fluoro-1-(3-propyltriazol-4-yl)-2,3-dihydroinden-1-ol
CID 114685403
(4-methylcyclohexyl)-(3-propyltriazol-4-yl)methanone
CID 114685710

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol?
The IUPAC name of 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol (CID 130555176) is 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol.
What is the SMILES notation for 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol?
The canonical SMILES for 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol is CCCn1nncc1C1(O)CCC1C.
What is the InChIKey of 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol?
The InChIKey is ZYWMGXTYONHAGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-6-13-9(7-11-12-13)10(14)5-4-8(10)2/h7-8,14H,3-6H2,1-2H3.
What are the key properties of 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol?
2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol has a molecular weight of 195.27 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(3-propyltriazol-4-yl)cyclobutan-1-ol is sourced from PubChem (CID 130555176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).