1-ethenyl-1,3-diazinane

C6H12N2 — CID 54013702

IUPAC1-ethenyl-1,3-diazinane
SMILESC=CN1CCCNC1
InChIInChI=1S/C6H12N2/c1-2-8-5-3-4-7-6-8/h2,7H,1,3-6H2
InChIKeyKUDCRAGTDOJASX-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.38
Rot. Bonds1

About 1-ethenyl-1,3-diazinane

1-ethenyl-1,3-diazinane (PubChem CID 54013702) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 1-ethenyl-1,3-diazinane.

Molecular Properties

Compound Name1-ethenyl-1,3-diazinane
PubChem CID54013702
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name1-ethenyl-1,3-diazinane
SMILESC=CN1CCCNC1
InChIInChI=1S/C6H12N2/c1-2-8-5-3-4-7-6-8/h2,7H,1,3-6H2
InChIKeyKUDCRAGTDOJASX-UHFFFAOYSA-N
XLogP0.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-diazepane-1-carbaldehyde
CID 91255378
bis(1-ethenylpyrrolidine);hydrogen peroxide
CID 90220929
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1-ethenylpyrrolidine;trichlorogold
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1,4,8,11-tetrazacyclotetradecane-1,4,8-tricarbaldehyde
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1-ethenylpyrrolidine;pyrrolidin-2-one
CID 174946746
azetidine;prop-1-ene
CID 168888111
1,7-diazacyclododecane-1-carbaldehyde
CID 123495230
1-ethenyl-4-oxidopiperazine
CID 87801359
prop-2-enoic acid;pyrrolidine
CID 159655910
4-ethenyl-1,4-thiazinane 1-oxide
CID 171832065
N-imidazolidin-1-ylprop-2-enamide
CID 68795651

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-1,3-diazinane?
The IUPAC name of 1-ethenyl-1,3-diazinane (CID 54013702) is 1-ethenyl-1,3-diazinane.
What is the SMILES notation for 1-ethenyl-1,3-diazinane?
The canonical SMILES for 1-ethenyl-1,3-diazinane is C=CN1CCCNC1.
What is the InChIKey of 1-ethenyl-1,3-diazinane?
The InChIKey is KUDCRAGTDOJASX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-2-8-5-3-4-7-6-8/h2,7H,1,3-6H2.
What are the key properties of 1-ethenyl-1,3-diazinane?
1-ethenyl-1,3-diazinane has a molecular weight of 112.18 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-1,3-diazinane is sourced from PubChem (CID 54013702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).