[1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol

C11H18N4O — CID 79645746

IUPAC[1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol
SMILESOCC1(NC2CC2)CCC(n2cncn2)C1
InChIInChI=1S/C11H18N4O/c16-6-11(14-9-1-2-9)4-3-10(5-11)15-8-12-7-13-15/h7-10,14,16H,1-6H2
InChIKeyRGOXGXVTPUNXLB-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.49
Rot. Bonds4

About [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol

[1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol (PubChem CID 79645746) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol
PubChem CID79645746
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name[1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol
SMILESOCC1(NC2CC2)CCC(n2cncn2)C1
InChIInChI=1S/C11H18N4O/c16-6-11(14-9-1-2-9)4-3-10(5-11)15-8-12-7-13-15/h7-10,14,16H,1-6H2
InChIKeyRGOXGXVTPUNXLB-UHFFFAOYSA-N
XLogP0.49
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(methylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol
CID 79645487
3-(cyclopropylamino)-3-(hydroxymethyl)cyclopentan-1-ol
CID 164644074
1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide
CID 79650821
[1-(cyclopropylamino)-3-indazol-1-ylcyclohexyl]methanol
CID 79638463
1-(ethylamino)-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide
CID 79650892
[1-(cyclopropylamino)-3-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)cyclopentyl]methanol
CID 79646242
[3-(azepan-1-yl)-1-(cyclopropylamino)cyclohexyl]methanol
CID 79633952
methyl 1-(ethylamino)-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxylate
CID 79651322
[1-(cyclopropylamino)-3-(2,5-dimethylmorpholin-4-yl)cyclopentyl]methanol
CID 79656126
[1-(cyclopropylamino)-3-methoxycyclopentyl]methanol
CID 79647805
[1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol
CID 102968918
[1-(cyclopropylamino)-3-(1,3-dihydroisoindol-2-yl)cyclohexyl]methanol
CID 79634509

Frequently Asked Questions

What is the IUPAC name of [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol?
The IUPAC name of [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol (CID 79645746) is [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol.
What is the SMILES notation for [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol?
The canonical SMILES for [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol is OCC1(NC2CC2)CCC(n2cncn2)C1.
What is the InChIKey of [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol?
The InChIKey is RGOXGXVTPUNXLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c16-6-11(14-9-1-2-9)4-3-10(5-11)15-8-12-7-13-15/h7-10,14,16H,1-6H2.
What are the key properties of [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol?
[1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol has a molecular weight of 222.29 g/mol, XLogP of 0.49, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopropylamino)-3-(1,2,4-triazol-1-yl)cyclopentyl]methanol is sourced from PubChem (CID 79645746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).