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

C14H19N3O3 — CID 115758335

IUPAC1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol
SMILESCN(Cc1nnc(-c2ccco2)o1)CC1(O)CCCC1
InChIInChI=1S/C14H19N3O3/c1-17(10-14(18)6-2-3-7-14)9-12-15-16-13(20-12)11-5-4-8-19-11/h4-5,8,18H,2-3,6-7,9-10H2,1H3
InChIKeyCFHYZRAIFQVJBP-UHFFFAOYSA-N
MW277.32 g/mol
LogP2.07
Rot. Bonds5

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

1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol (PubChem CID 115758335) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol
PubChem CID115758335
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol
SMILESCN(Cc1nnc(-c2ccco2)o1)CC1(O)CCCC1
InChIInChI=1S/C14H19N3O3/c1-17(10-14(18)6-2-3-7-14)9-12-15-16-13(20-12)11-5-4-8-19-11/h4-5,8,18H,2-3,6-7,9-10H2,1H3
InChIKeyCFHYZRAIFQVJBP-UHFFFAOYSA-N
XLogP2.07
TPSA75.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol (CID 115758335) is 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol is CN(Cc1nnc(-c2ccco2)o1)CC1(O)CCCC1.
What is the InChIKey of 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol?
The InChIKey is CFHYZRAIFQVJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-17(10-14(18)6-2-3-7-14)9-12-15-16-13(20-12)11-5-4-8-19-11/h4-5,8,18H,2-3,6-7,9-10H2,1H3.
What are the key properties of 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol?
1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol has a molecular weight of 277.32 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 115758335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).