1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine

C14H23N3O — CID 64673214

IUPAC1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine
SMILESNC1(Cc2nc(C3CCCC3)no2)CCCCC1
InChIInChI=1S/C14H23N3O/c15-14(8-4-1-5-9-14)10-12-16-13(17-18-12)11-6-2-3-7-11/h11H,1-10,15H2
InChIKeyMXWDSNSTJIMVKS-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.93
Rot. Bonds3

About 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine

1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine (PubChem CID 64673214) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine
PubChem CID64673214
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine
SMILESNC1(Cc2nc(C3CCCC3)no2)CCCCC1
InChIInChI=1S/C14H23N3O/c15-14(8-4-1-5-9-14)10-12-16-13(17-18-12)11-6-2-3-7-11/h11H,1-10,15H2
InChIKeyMXWDSNSTJIMVKS-UHFFFAOYSA-N
XLogP2.93
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine (CID 64673214) is 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine is NC1(Cc2nc(C3CCCC3)no2)CCCCC1.
What is the InChIKey of 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine?
The InChIKey is MXWDSNSTJIMVKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c15-14(8-4-1-5-9-14)10-12-16-13(17-18-12)11-6-2-3-7-11/h11H,1-10,15H2.
What are the key properties of 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine?
1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine has a molecular weight of 249.36 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-cyclopentyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 64673214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).