3-methylazete

C4H5N — CID 58230855

IUPAC3-methylazete
SMILESCC1=CN=C1
InChIInChI=1S/C4H5N/c1-4-2-5-3-4/h2-3H,1H3
InChIKeyIZTNGBMQWNQFNX-UHFFFAOYSA-N
MW67.09 g/mol
LogP0.97
Rot. Bonds

About 3-methylazete

3-methylazete (PubChem CID 58230855) has the molecular formula C4H5N and a molecular weight of 67.09 g/mol. Its IUPAC name is 3-methylazete.

Molecular Properties

Compound Name3-methylazete
PubChem CID58230855
Molecular FormulaC4H5N
Molecular Weight67.09 g/mol
Exact Mass67.04
IUPAC Name3-methylazete
SMILESCC1=CN=C1
InChIInChI=1S/C4H5N/c1-4-2-5-3-4/h2-3H,1H3
InChIKeyIZTNGBMQWNQFNX-UHFFFAOYSA-N
XLogP0.97
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50067.09
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-propylprop-2-en-1-imine
CID 15326646
N-[(E)-2-fluoroprop-1-enyl]-2-methylprop-2-en-1-imine
CID 143939006
N,2-dimethylprop-2-en-1-imine
CID 12510993
N-propylidene-(2-methylpropenylamine)
CID 12941767
(Z)-N,N,2-trimethyl-3-methyliminoprop-1-en-1-amine
CID 20667854
N-ethyl-2-methylprop-2-en-1-imine
CID 53806843
Methyl-(2-methyl-3-methyliminoprop-1-enyl)azanide
CID 58028323
(E)-N,N,2-trimethyl-3-methyliminoprop-1-en-1-amine
CID 59959971
6-methyl-2H-1,4-diazepine
CID 68265859
(Z)-N'-ethylidene-N,2-dimethylprop-2-ene-1,3-diimine
CID 88575448
2-methyl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine
CID 88885972
(Z)-N,2-dimethyl-N'-methylideneprop-2-ene-1,3-diimine
CID 88988227

Frequently Asked Questions

What is the IUPAC name of 3-methylazete?
The IUPAC name of 3-methylazete (CID 58230855) is 3-methylazete.
What is the SMILES notation for 3-methylazete?
The canonical SMILES for 3-methylazete is CC1=CN=C1.
What is the InChIKey of 3-methylazete?
The InChIKey is IZTNGBMQWNQFNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N/c1-4-2-5-3-4/h2-3H,1H3.
What are the key properties of 3-methylazete?
3-methylazete has a molecular weight of 67.09 g/mol, XLogP of 0.97, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylazete is sourced from PubChem (CID 58230855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).