1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol

C10H17N3O2 — CID 65111678

IUPAC1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol
SMILESCc1nonc1CNCC1(O)CCCC1
InChIInChI=1S/C10H17N3O2/c1-8-9(13-15-12-8)6-11-7-10(14)4-2-3-5-10/h11,14H,2-7H2,1H3
InChIKeyJUBFESHUAYVZNO-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.77
Rot. Bonds4

About 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol

1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol (PubChem CID 65111678) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol
PubChem CID65111678
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol
SMILESCc1nonc1CNCC1(O)CCCC1
InChIInChI=1S/C10H17N3O2/c1-8-9(13-15-12-8)6-11-7-10(14)4-2-3-5-10/h11,14H,2-7H2,1H3
InChIKeyJUBFESHUAYVZNO-UHFFFAOYSA-N
XLogP0.77
TPSA71.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol (CID 65111678) is 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol is Cc1nonc1CNCC1(O)CCCC1.
What is the InChIKey of 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol?
The InChIKey is JUBFESHUAYVZNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-8-9(13-15-12-8)6-11-7-10(14)4-2-3-5-10/h11,14H,2-7H2,1H3.
What are the key properties of 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol?
1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol has a molecular weight of 211.26 g/mol, XLogP of 0.77, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65111678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).