N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide

C12H21N5O2 — CID 106970901

IUPACN-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1c1nnc(C(C)NC)o1
InChIInChI=1S/C12H21N5O2/c1-8(13-2)11-15-16-12(19-11)17-7-5-4-6-9(17)10(18)14-3/h8-9,13H,4-7H2,1-3H3,(H,14,18)
InChIKeyDCUJOUKWYNZBNM-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.45
Rot. Bonds4

About N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide

N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide (PubChem CID 106970901) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide
PubChem CID106970901
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC NameN-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1c1nnc(C(C)NC)o1
InChIInChI=1S/C12H21N5O2/c1-8(13-2)11-15-16-12(19-11)17-7-5-4-6-9(17)10(18)14-3/h8-9,13H,4-7H2,1-3H3,(H,14,18)
InChIKeyDCUJOUKWYNZBNM-UHFFFAOYSA-N
XLogP0.45
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide?
The IUPAC name of N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide (CID 106970901) is N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide?
The canonical SMILES for N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide is CNC(=O)C1CCCCN1c1nnc(C(C)NC)o1.
What is the InChIKey of N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide?
The InChIKey is DCUJOUKWYNZBNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-8(13-2)11-15-16-12(19-11)17-7-5-4-6-9(17)10(18)14-3/h8-9,13H,4-7H2,1-3H3,(H,14,18).
What are the key properties of N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide?
N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 0.45, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]piperidine-2-carboxamide is sourced from PubChem (CID 106970901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).