2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine

C11H19N3O — CID 64908898

IUPAC2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine
SMILESCc1nonc1CNC1CCC(C)C1C
InChIInChI=1S/C11H19N3O/c1-7-4-5-10(8(7)2)12-6-11-9(3)13-15-14-11/h7-8,10,12H,4-6H2,1-3H3
InChIKeyJVDAOEITDHHBJE-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.90
Rot. Bonds3

About 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine

2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine (PubChem CID 64908898) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine
PubChem CID64908898
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine
SMILESCc1nonc1CNC1CCC(C)C1C
InChIInChI=1S/C11H19N3O/c1-7-4-5-10(8(7)2)12-6-11-9(3)13-15-14-11/h7-8,10,12H,4-6H2,1-3H3
InChIKeyJVDAOEITDHHBJE-UHFFFAOYSA-N
XLogP1.90
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine (CID 64908898) is 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine is Cc1nonc1CNC1CCC(C)C1C.
What is the InChIKey of 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine?
The InChIKey is JVDAOEITDHHBJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-7-4-5-10(8(7)2)12-6-11-9(3)13-15-14-11/h7-8,10,12H,4-6H2,1-3H3.
What are the key properties of 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine?
2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine has a molecular weight of 209.29 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 64908898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).