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

C11H20N4O — CID 106964701

IUPACN-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine
SMILESCCNCc1nnc(NCC(C)C2CC2)o1
InChIInChI=1S/C11H20N4O/c1-3-12-7-10-14-15-11(16-10)13-6-8(2)9-4-5-9/h8-9,12H,3-7H2,1-2H3,(H,13,15)
InChIKeyDXIQWYPNRLBTMZ-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.64
Rot. Bonds7

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

N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine (PubChem CID 106964701) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine
PubChem CID106964701
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC NameN-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine
SMILESCCNCc1nnc(NCC(C)C2CC2)o1
InChIInChI=1S/C11H20N4O/c1-3-12-7-10-14-15-11(16-10)13-6-8(2)9-4-5-9/h8-9,12H,3-7H2,1-2H3,(H,13,15)
InChIKeyDXIQWYPNRLBTMZ-UHFFFAOYSA-N
XLogP1.64
TPSA62.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(ethylaminomethyl)-N-(2-methylbutyl)-1,3,4-oxadiazol-2-amine
CID 106960518
5-(ethylaminomethyl)-N-(2-phenylpropyl)-1,3,4-oxadiazol-2-amine
CID 106964891
5-(1-chloroethyl)-N-(2-cyclopropylpropyl)-1,3,4-oxadiazol-2-amine
CID 106958531
5-(ethylaminomethyl)-N-(2-ethylhexyl)-1,3,4-oxadiazol-2-amine
CID 107819593
5-(ethylaminomethyl)-N-(5-methylhexyl)-1,3,4-oxadiazol-2-amine
CID 106963651
N-cyclopropyl-2-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]propanamide
CID 106964200
5-[(2-methylpropylamino)methyl]-N-(thian-4-ylmethyl)-1,3,4-oxadiazol-2-amine
CID 106964746
5-(ethylaminomethyl)-N-[(3-methylcyclohexyl)methyl]-1,3,4-oxadiazol-2-amine
CID 114131448
N-(3-ethoxypropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106967947
5-[(2-methylpropylamino)methyl]-N-(oxan-3-ylmethyl)-1,3,4-oxadiazol-2-amine
CID 106971002
2-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]propanamide
CID 106964121
5-(ethylaminomethyl)-N-[(4-ethylphenyl)methyl]-1,3,4-oxadiazol-2-amine
CID 106967437

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine (CID 106964701) is N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine is CCNCc1nnc(NCC(C)C2CC2)o1.
What is the InChIKey of N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine?
The InChIKey is DXIQWYPNRLBTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-3-12-7-10-14-15-11(16-10)13-6-8(2)9-4-5-9/h8-9,12H,3-7H2,1-2H3,(H,13,15).
What are the key properties of N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine?
N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine has a molecular weight of 224.31 g/mol, XLogP of 1.64, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-5-(ethylaminomethyl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 106964701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).