N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine

C10H20N4O — CID 106966149

IUPACN-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine
SMILESCCCCN(C)c1nnc(CNCC)o1
InChIInChI=1S/C10H20N4O/c1-4-6-7-14(3)10-13-12-9(15-10)8-11-5-2/h11H,4-8H2,1-3H3
InChIKeyVERCHTHRSXLQLK-UHFFFAOYSA-N
MW212.30 g/mol
LogP1.42
Rot. Bonds7

About N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine

N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine (PubChem CID 106966149) has the molecular formula C10H20N4O and a molecular weight of 212.30 g/mol. Its IUPAC name is N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine
PubChem CID106966149
Molecular FormulaC10H20N4O
Molecular Weight212.30 g/mol
Exact Mass212.16
IUPAC NameN-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine
SMILESCCCCN(C)c1nnc(CNCC)o1
InChIInChI=1S/C10H20N4O/c1-4-6-7-14(3)10-13-12-9(15-10)8-11-5-2/h11H,4-8H2,1-3H3
InChIKeyVERCHTHRSXLQLK-UHFFFAOYSA-N
XLogP1.42
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-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

2-[butyl-[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]ethanol
CID 106970325
3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-methylpropanamide
CID 106967463
N-butyl-5-(ethylaminomethyl)-N-phenyl-1,3,4-oxadiazol-2-amine
CID 106962273
5-[[5-[(2-methoxyethylamino)methyl]-1,3,4-oxadiazol-2-yl]-methylamino]pentan-1-ol
CID 107207682
5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine
CID 106968742
N-(2,2-difluoroethyl)-N-methyl-5-(propylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106965364
N-butyl-N-ethyl-5-[(2-methoxyethylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106966919
N'-[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 106969906
5-(ethylaminomethyl)-N-methyl-N-phenyl-1,3,4-oxadiazol-2-amine
CID 106967692
2-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]-pentan-3-ylamino]ethanol
CID 106959307
N-butyl-5-(1-chloroethyl)-N-methyl-1,3,4-oxadiazol-2-amine
CID 106958895
N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 25218857

Frequently Asked Questions

What is the IUPAC name of N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine (CID 106966149) is N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine is CCCCN(C)c1nnc(CNCC)o1.
What is the InChIKey of N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine?
The InChIKey is VERCHTHRSXLQLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O/c1-4-6-7-14(3)10-13-12-9(15-10)8-11-5-2/h11H,4-8H2,1-3H3.
What are the key properties of N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine?
N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine has a molecular weight of 212.30 g/mol, XLogP of 1.42, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-5-(ethylaminomethyl)-N-methyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 106966149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).