5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine

C7H12N4O — CID 82468042

IUPAC5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine
SMILESNc1nnc(CCNC2CC2)o1
InChIInChI=1S/C7H12N4O/c8-7-11-10-6(12-7)3-4-9-5-1-2-5/h5,9H,1-4H2,(H2,8,11)
InChIKeyIIUFSTGTSOBTDN-UHFFFAOYSA-N
MW168.20 g/mol
LogP-0.05
Rot. Bonds4

About 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine

5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine (PubChem CID 82468042) has the molecular formula C7H12N4O and a molecular weight of 168.20 g/mol. Its IUPAC name is 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine
PubChem CID82468042
Molecular FormulaC7H12N4O
Molecular Weight168.20 g/mol
Exact Mass168.10
IUPAC Name5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine
SMILESNc1nnc(CCNC2CC2)o1
InChIInChI=1S/C7H12N4O/c8-7-11-10-6(12-7)3-4-9-5-1-2-5/h5,9H,1-4H2,(H2,8,11)
InChIKeyIIUFSTGTSOBTDN-UHFFFAOYSA-N
XLogP-0.05
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(5-pentan-3-yl-1,3,4-oxadiazol-2-yl)ethyl]cyclopropanamine
CID 62162767
N-[2-[5-(propan-2-yloxymethyl)-1,3,4-oxadiazol-2-yl]ethyl]cyclopropanamine
CID 112603888
N-[2-[5-(1,1,2,2-tetrafluoroethyl)-1,3,4-oxadiazol-2-yl]ethyl]cyclopropanamine
CID 104632969
N-[2-[5-(oxan-2-yl)-1,3,4-oxadiazol-2-yl]ethyl]cyclopropanamine
CID 62214456
N-[2-[5-(3,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]cyclopropanamine
CID 55044397
N-[2-[5-(5-bromo-2-pyridinyl)-1,3,4-oxadiazol-2-yl]ethyl]cyclopropanamine
CID 62960149
N-[2-[5-[(3-bromophenyl)methyl]-1,3,4-oxadiazol-2-yl]ethyl]cyclopropanamine
CID 62163473
N-[2-(1,3-oxazol-2-yl)ethyl]cyclopropanamine
CID 82467812
N-[2-[5-(4-bromo-3-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]cyclopropanamine
CID 55044350
N-[3-(5-pentan-3-yl-1,3,4-oxadiazol-2-yl)propyl]cyclopropanamine
CID 62137109
N-[2-[5-(3,4-dihydro-2H-chromen-3-yl)-1,3,4-oxadiazol-2-yl]ethyl]cyclopropanamine
CID 63589115
5-(cyclohexylmethyl)-1,3,4-oxadiazol-2-amine
CID 28780022

Frequently Asked Questions

What is the IUPAC name of 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine (CID 82468042) is 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine is Nc1nnc(CCNC2CC2)o1.
What is the InChIKey of 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine?
The InChIKey is IIUFSTGTSOBTDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O/c8-7-11-10-6(12-7)3-4-9-5-1-2-5/h5,9H,1-4H2,(H2,8,11).
What are the key properties of 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine?
5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine has a molecular weight of 168.20 g/mol, XLogP of -0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(cyclopropylamino)ethyl]-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 82468042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).