N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine

C14H20N4O — CID 106967971

IUPACN-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine
SMILESCCNC(C)c1nnc(N(CC)c2ccccc2)o1
InChIInChI=1S/C14H20N4O/c1-4-15-11(3)13-16-17-14(19-13)18(5-2)12-9-7-6-8-10-12/h6-11,15H,4-5H2,1-3H3
InChIKeyKLFVPPMRZVOQER-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.90
Rot. Bonds6

About N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine

N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine (PubChem CID 106967971) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine
PubChem CID106967971
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine
SMILESCCNC(C)c1nnc(N(CC)c2ccccc2)o1
InChIInChI=1S/C14H20N4O/c1-4-15-11(3)13-16-17-14(19-13)18(5-2)12-9-7-6-8-10-12/h6-11,15H,4-5H2,1-3H3
InChIKeyKLFVPPMRZVOQER-UHFFFAOYSA-N
XLogP2.90
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-N-(2-methylphenyl)-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106966906
2-N-ethyl-2-N-phenyl-1,3,4-oxadiazole-2,5-diamine
CID 103436569
5-[1-(ethylamino)ethyl]-N-(3-fluorophenyl)-N-methyl-1,3,4-oxadiazol-2-amine
CID 106971235
2-[benzyl-[5-[1-(ethylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]ethanol
CID 106960309
5-[1-(ethylamino)ethyl]-N-(3-methoxyphenyl)-N-methyl-1,3,4-oxadiazol-2-amine
CID 106970478
N-ethyl-2-[1-(ethylamino)ethyl]-N-phenylaniline
CID 43284278
N-[(2-chlorophenyl)methyl]-5-[1-(ethylamino)ethyl]-N-methyl-1,3,4-oxadiazol-2-amine
CID 106960112
N-methyl-N-(2-phenylethyl)-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106961805
5-[1-(ethylamino)ethyl]-N-(3-phenylpropyl)-1,3,4-oxadiazol-2-amine
CID 106969532
N-ethyl-N-phenyl-5-(propylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106967964
2-[[5-[1-(ethylamino)ethyl]-1,3,4-oxadiazol-2-yl]-methylamino]ethanol
CID 106969645
N-ethyl-1-[5-(2-iodophenyl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 62164274

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine (CID 106967971) is N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine is CCNC(C)c1nnc(N(CC)c2ccccc2)o1.
What is the InChIKey of N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine?
The InChIKey is KLFVPPMRZVOQER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-4-15-11(3)13-16-17-14(19-13)18(5-2)12-9-7-6-8-10-12/h6-11,15H,4-5H2,1-3H3.
What are the key properties of N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine?
N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine has a molecular weight of 260.34 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-[1-(ethylamino)ethyl]-N-phenyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 106967971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).