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

C14H26N4O — CID 115078063

IUPACN-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine
SMILESCNC(C)Cc1noc(C2CCCCN2C(C)C)n1
InChIInChI=1S/C14H26N4O/c1-10(2)18-8-6-5-7-12(18)14-16-13(17-19-14)9-11(3)15-4/h10-12,15H,5-9H2,1-4H3
InChIKeyMWUXKMQREFXSIW-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.16
Rot. Bonds5

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

N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine (PubChem CID 115078063) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine.

Molecular Properties

Compound NameN-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine
PubChem CID115078063
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine
SMILESCNC(C)Cc1noc(C2CCCCN2C(C)C)n1
InChIInChI=1S/C14H26N4O/c1-10(2)18-8-6-5-7-12(18)14-16-13(17-19-14)9-11(3)15-4/h10-12,15H,5-9H2,1-4H3
InChIKeyMWUXKMQREFXSIW-UHFFFAOYSA-N
XLogP2.16
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine?
The IUPAC name of N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine (CID 115078063) is N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine.
What is the SMILES notation for N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine?
The canonical SMILES for N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine is CNC(C)Cc1noc(C2CCCCN2C(C)C)n1.
What is the InChIKey of N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine?
The InChIKey is MWUXKMQREFXSIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-10(2)18-8-6-5-7-12(18)14-16-13(17-19-14)9-11(3)15-4/h10-12,15H,5-9H2,1-4H3.
What are the key properties of N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine?
N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine has a molecular weight of 266.39 g/mol, XLogP of 2.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(1-propan-2-ylpiperidin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine is sourced from PubChem (CID 115078063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).