N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine

C8H13N3O2 — CID 130840823

IUPACN-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine
SMILESCC(Nc1nnco1)C1CCCO1
InChIInChI=1S/C8H13N3O2/c1-6(7-3-2-4-12-7)10-8-11-9-5-13-8/h5-7H,2-4H2,1H3,(H,10,11)
InChIKeyFDNWGBXVPGSFFC-UHFFFAOYSA-N
MW183.21 g/mol
LogP1.05
Rot. Bonds3

About N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine

N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine (PubChem CID 130840823) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine
PubChem CID130840823
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC NameN-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine
SMILESCC(Nc1nnco1)C1CCCO1
InChIInChI=1S/C8H13N3O2/c1-6(7-3-2-4-12-7)10-8-11-9-5-13-8/h5-7H,2-4H2,1H3,(H,10,11)
InChIKeyFDNWGBXVPGSFFC-UHFFFAOYSA-N
XLogP1.05
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-N-[1-(oxolan-2-yl)ethyl]-1,2,4-triazin-5-amine
CID 82237452
5-[(cyclopropylamino)methyl]-N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine
CID 106969066
4-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-4,5-diamine
CID 82236284
2-N,5-dimethyl-4-N-[1-(oxolan-2-yl)ethyl]pyrimidine-2,4-diamine
CID 80780776
6-N-methyl-2-methylsulfanyl-4-N-[1-(oxolan-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80782113
2-methyl-4-N-[1-(oxolan-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80780884
4-N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]pyridine-3,4-diamine
CID 93103324
N-[1-(oxolan-2-yl)ethyl]bicyclo[3.1.0]hexan-3-amine
CID 130791757
1-(oxolan-2-yl)ethylthiourea
CID 43533883
N-[1-(oxolan-2-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 115601307
4-N-[1-(oxolan-2-yl)ethyl]benzene-1,2,4-triamine
CID 106750412
4,5-dimethyl-N-[1-(oxolan-2-yl)ethyl]-1,3-thiazol-2-amine
CID 65169694

Frequently Asked Questions

What is the IUPAC name of N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine (CID 130840823) is N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine is CC(Nc1nnco1)C1CCCO1.
What is the InChIKey of N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine?
The InChIKey is FDNWGBXVPGSFFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-6(7-3-2-4-12-7)10-8-11-9-5-13-8/h5-7H,2-4H2,1H3,(H,10,11).
What are the key properties of N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine?
N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine has a molecular weight of 183.21 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 130840823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).