N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine

C10H18N4O — CID 106660193

IUPACN-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine
SMILESCCN(CC1CCCN1)c1nc(C)no1
InChIInChI=1S/C10H18N4O/c1-3-14(7-9-5-4-6-11-9)10-12-8(2)13-15-10/h9,11H,3-7H2,1-2H3
InChIKeyMXSKBZNCJNKISY-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.96
Rot. Bonds4

About N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine

N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine (PubChem CID 106660193) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine
PubChem CID106660193
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine
SMILESCCN(CC1CCCN1)c1nc(C)no1
InChIInChI=1S/C10H18N4O/c1-3-14(7-9-5-4-6-11-9)10-12-8(2)13-15-10/h9,11H,3-7H2,1-2H3
InChIKeyMXSKBZNCJNKISY-UHFFFAOYSA-N
XLogP0.96
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,3-dimethyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine
CID 83831221
N-ethyl-6-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106619421
N-ethyl-N-(piperidin-2-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 106632658
N-ethyl-2-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
CID 28598067
5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine
CID 114046810
N-ethyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 4715267
6-[ethyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 106619350
4,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propylpyrimidin-2-amine
CID 106642566
N-ethyl-6-propoxy-N-(pyrrolidin-2-ylmethyl)pyrazin-2-amine
CID 106619398
5,6-dimethyl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrazin-2-amine
CID 106619724
N-ethyl-2-fluoro-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
CID 102819482
N,4,6-trimethyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 71641961

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine?
The IUPAC name of N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine (CID 106660193) is N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine?
The canonical SMILES for N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine is CCN(CC1CCCN1)c1nc(C)no1.
What is the InChIKey of N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine?
The InChIKey is MXSKBZNCJNKISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-3-14(7-9-5-4-6-11-9)10-12-8(2)13-15-10/h9,11H,3-7H2,1-2H3.
What are the key properties of N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine?
N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine has a molecular weight of 210.28 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-N-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 106660193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).