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

C11H19N5O2 — CID 106965704

IUPACN-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide
SMILESCNCc1nnc(N2CCCC(C(=O)NC)C2)o1
InChIInChI=1S/C11H19N5O2/c1-12-6-9-14-15-11(18-9)16-5-3-4-8(7-16)10(17)13-2/h8,12H,3-7H2,1-2H3,(H,13,17)
InChIKeyJZROLXCMHIWUKH-UHFFFAOYSA-N
MW253.31 g/mol
LogP-0.25
Rot. Bonds4

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

N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide (PubChem CID 106965704) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide
PubChem CID106965704
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC NameN-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide
SMILESCNCc1nnc(N2CCCC(C(=O)NC)C2)o1
InChIInChI=1S/C11H19N5O2/c1-12-6-9-14-15-11(18-9)16-5-3-4-8(7-16)10(17)13-2/h8,12H,3-7H2,1-2H3,(H,13,17)
InChIKeyJZROLXCMHIWUKH-UHFFFAOYSA-N
XLogP-0.25
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-[5-[(2-methoxyethylamino)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpiperidine-3-carboxamide
CID 106965710
N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]pyrrolidine-2-carboxamide
CID 106959889
1-[5-(4-ethylazepan-1-yl)-1,3,4-oxadiazol-2-yl]-N-methylmethanamine
CID 106962399
1-[5-(4-tert-butylazepan-1-yl)-1,3,4-oxadiazol-2-yl]-N-methylmethanamine
CID 106962132
1-[5-[(cyclopropylamino)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpyrrolidine-2-carboxamide
CID 106959892
1-[5-(3,4-dimethylpyrrolidin-1-yl)-1,3,4-oxadiazol-2-yl]-N-methylmethanamine
CID 106962753
1-[5-[(tert-butylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidin-3-ol
CID 106959479
1-[5-(propylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-3-ol
CID 106959475
6-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]-1,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-2-one
CID 106963632
1-[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]pyrrolidin-3-ol
CID 106960694
1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide
CID 103197464
5-[3-(methylcarbamoyl)piperidin-1-yl]furan-2-carboxylic acid
CID 103196251

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide?
The IUPAC name of N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide (CID 106965704) is N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide?
The canonical SMILES for N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide is CNCc1nnc(N2CCCC(C(=O)NC)C2)o1.
What is the InChIKey of N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide?
The InChIKey is JZROLXCMHIWUKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c1-12-6-9-14-15-11(18-9)16-5-3-4-8(7-16)10(17)13-2/h8,12H,3-7H2,1-2H3,(H,13,17).
What are the key properties of N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide?
N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide has a molecular weight of 253.31 g/mol, XLogP of -0.25, 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-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide is sourced from PubChem (CID 106965704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).