1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine

C14H23N3O — CID 55091396

IUPAC1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine
SMILESNC1(c2noc(C3CCCCCC3)n2)CCCC1
InChIInChI=1S/C14H23N3O/c15-14(9-5-6-10-14)13-16-12(18-17-13)11-7-3-1-2-4-8-11/h11H,1-10,15H2
InChIKeyXUOHBCNUKLTXBD-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.24
Rot. Bonds2

About 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine

1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine (PubChem CID 55091396) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine
PubChem CID55091396
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine
SMILESNC1(c2noc(C3CCCCCC3)n2)CCCC1
InChIInChI=1S/C14H23N3O/c15-14(9-5-6-10-14)13-16-12(18-17-13)11-7-3-1-2-4-8-11/h11H,1-10,15H2
InChIKeyXUOHBCNUKLTXBD-UHFFFAOYSA-N
XLogP3.24
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine
CID 62589652
1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)cyclopropan-1-amine;hydrochloride
CID 67390539
1-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)-4-methylcyclohexan-1-amine
CID 61354523
1-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)-3-methylcyclohexan-1-amine
CID 61352528
1-[5-(thiolan-2-yl)-1,2,4-oxadiazol-3-yl]cyclopentan-1-amine;hydrochloride
CID 120855602
1-[5-(oxolan-3-yl)-1,2,4-oxadiazol-3-yl]cyclobutan-1-amine
CID 120859662
1-[5-(4-phenylcyclohexyl)-1,2,4-oxadiazol-3-yl]cyclobutan-1-amine;hydrochloride
CID 120860751
1-[5-(5-methyloxolan-2-yl)-1,2,4-oxadiazol-3-yl]cyclohexan-1-amine
CID 81327799
1-[5-(2-cyclohexylcyclopropyl)-1,2,4-oxadiazol-3-yl]cyclobutan-1-amine
CID 120862372
1-[4-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]butan-1-one
CID 120853388
1-[5-[3-(trifluoromethyl)cyclohexyl]-1,2,4-oxadiazol-3-yl]cyclobutan-1-amine;hydrochloride
CID 120860181
1-[3-[3-(1-aminocyclopentyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]butan-1-one
CID 120856198

Frequently Asked Questions

What is the IUPAC name of 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine?
The IUPAC name of 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine (CID 55091396) is 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine.
What is the SMILES notation for 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine?
The canonical SMILES for 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine is NC1(c2noc(C3CCCCCC3)n2)CCCC1.
What is the InChIKey of 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine?
The InChIKey is XUOHBCNUKLTXBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c15-14(9-5-6-10-14)13-16-12(18-17-13)11-7-3-1-2-4-8-11/h11H,1-10,15H2.
What are the key properties of 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine?
1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine has a molecular weight of 249.36 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine is sourced from PubChem (CID 55091396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).