4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide

C10H15N3 — CID 145110941

IUPAC4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide
SMILES[H]/N=C(\N)N1CCC(C=C)=C(C=C)C1
InChIInChI=1S/C10H15N3/c1-3-8-5-6-13(10(11)12)7-9(8)4-2/h3-4H,1-2,5-7H2,(H3,11,12)
InChIKeyQMZRZHJKPNDKMV-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.25
Rot. Bonds2

About 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide

4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide (PubChem CID 145110941) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide.

Molecular Properties

Compound Name4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide
PubChem CID145110941
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide
SMILES[H]/N=C(\N)N1CCC(C=C)=C(C=C)C1
InChIInChI=1S/C10H15N3/c1-3-8-5-6-13(10(11)12)7-9(8)4-2/h3-4H,1-2,5-7H2,(H3,11,12)
InChIKeyQMZRZHJKPNDKMV-UHFFFAOYSA-N
XLogP1.25
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

3-ethyl-2H-pyridine-1-carboximidamide
CID 123475756
1-[(2E,4Z)-2,4-dimethylhexa-2,4-dienyl]-1-propylguanidine
CID 139324978
4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide
CID 142863718
[4,5-bis(ethenyl)-3,6-dihydro-2H-pyridin-1-yl]methanamine
CID 142879430
ethane;4-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide
CID 143657701
2-[N-(2-cyclohexa-1,5-dien-1-ylethyl)-N-methylcarbamimidoyl]-1,1-dipropylguanidine
CID 144216890
[4,5-bis(ethenyl)-3,6-dihydro-2H-pyridin-1-yl]methanimine;methanamine
CID 145111049
1,3,4,5-Tetrahydroisoindole-2-carboximidamide
CID 145111194
4-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide
CID 143657702
[4,5-bis(ethenyl)-3,6-dihydro-2H-pyridin-1-yl]methanimine
CID 145111050

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide?
The IUPAC name of 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide (CID 145110941) is 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide.
What is the SMILES notation for 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide?
The canonical SMILES for 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide is [H]/N=C(\N)N1CCC(C=C)=C(C=C)C1.
What is the InChIKey of 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide?
The InChIKey is QMZRZHJKPNDKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-3-8-5-6-13(10(11)12)7-9(8)4-2/h3-4H,1-2,5-7H2,(H3,11,12).
What are the key properties of 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide?
4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide has a molecular weight of 177.25 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide is sourced from PubChem (CID 145110941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).