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

C8H13N3O — CID 66033169

IUPAC3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
SMILESCc1noc(C2CCC(N)C2)n1
InChIInChI=1S/C8H13N3O/c1-5-10-8(12-11-5)6-2-3-7(9)4-6/h6-7H,2-4,9H2,1H3
InChIKeyRRGLKRIKGJGJAW-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.97
Rot. Bonds1

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

3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine (PubChem CID 66033169) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
PubChem CID66033169
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
SMILESCc1noc(C2CCC(N)C2)n1
InChIInChI=1S/C8H13N3O/c1-5-10-8(12-11-5)6-2-3-7(9)4-6/h6-7H,2-4,9H2,1H3
InChIKeyRRGLKRIKGJGJAW-UHFFFAOYSA-N
XLogP0.97
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-Ethyl-1,2,4-oxadiazol-5-yl)cyclopentanamine
CID 66033168
4-(3-Methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine hydrochloride
CID 71755671
4-(3-Ethyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine hydrochloride
CID 121605216
11-[3-(Propan-2-YL)-1,2,4-oxadiazol-5-YL]-tetradecahydrocyclopenta[B]1,5-diazacycloundecan-9-one
CID 110200664
4-(3-Methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine
CID 60812049
(1R,3S)-N-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine;2,2,2-trifluoroacetic acid
CID 117890093
[methyl-[(1R,3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentyl]amino] 2,2,2-trifluoroacetate
CID 117890096
3-[[3-(Trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl]cyclobutan-1-amine;hydrochloride
CID 146193960
3-[[3-(Trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl]cyclobutan-1-amine
CID 146193961
2-Fluoro-4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine
CID 147477748
2,2-Difluoro-4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine
CID 153179785
cis-(1R,3S)-3-[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine;hydrochloride
CID 156760181

Frequently Asked Questions

What is the IUPAC name of 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine?
The IUPAC name of 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine (CID 66033169) is 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine.
What is the SMILES notation for 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine?
The canonical SMILES for 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine is Cc1noc(C2CCC(N)C2)n1.
What is the InChIKey of 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine?
The InChIKey is RRGLKRIKGJGJAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5-10-8(12-11-5)6-2-3-7(9)4-6/h6-7H,2-4,9H2,1H3.
What are the key properties of 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine?
3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine has a molecular weight of 167.21 g/mol, XLogP of 0.97, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine is sourced from PubChem (CID 66033169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).