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

C11H17N3 — CID 142863718

IUPAC4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide
SMILESC=CC1=C(C=C)CN(/C(N)=N/C)CC1
InChIInChI=1S/C11H17N3/c1-4-9-6-7-14(11(12)13-3)8-10(9)5-2/h4-5H,1-2,6-8H2,3H3,(H2,12,13)
InChIKeyBCMMLENAEWUQOH-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.31
Rot. Bonds2

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

4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide (PubChem CID 142863718) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide.

Molecular Properties

Compound Name4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide
PubChem CID142863718
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide
SMILESC=CC1=C(C=C)CN(/C(N)=N/C)CC1
InChIInChI=1S/C11H17N3/c1-4-9-6-7-14(11(12)13-3)8-10(9)5-2/h4-5H,1-2,6-8H2,3H3,(H2,12,13)
InChIKeyBCMMLENAEWUQOH-UHFFFAOYSA-N
XLogP1.31
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.31
H-Bond Donors ≤ 51
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

N'-(N'-butylcarbamimidoyl)-3,6-dihydro-2H-pyridine-1-carboximidamide
CID 78321569
N'-(N'-butylcarbamimidoyl)-3,6-dihydro-2H-pyridine-1-carboximidamide
CID 123313033
6-N-(2-ethylpenta-2,4-dienyl)-2-N,2-N,6-N,4-tetramethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
CID 123354238
2-[N-(2-cyclohexa-1,5-dien-1-ylethyl)-N-methylcarbamimidoyl]-1,1-dipropylguanidine
CID 144216890
4,5-bis(ethenyl)-3,6-dihydro-2H-pyridine-1-carboximidamide
CID 145110941
[4,5-bis(ethenyl)-3,6-dihydro-2H-pyridin-1-yl]methanimine;methanamine
CID 145111049
4-Cyclohexa-1,5-dien-1-yl-1,3-dimethyl-2,4-dihydro-1,3,5-triazine-2,6-diamine
CID 149005303
1-(cyclohexa-1,5-dien-1-ylmethyl)-3-(N,N-dimethylcarbamimidoyl)-2-methylguanidine
CID 176543827
2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl]-1-prop-2-enylguanidine
CID 120190232
2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl]-1-(2-methylprop-2-enyl)guanidine
CID 120190272
2-methyl-1-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl]guanidine
CID 131209561
6-N,4-dimethyl-6-N-[(4-methylcyclopenta-1,4-dien-1-yl)methyl]-1,4-dihydro-1,3,5-triazine-2,6-diamine
CID 157151385

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide?
The IUPAC name of 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide (CID 142863718) is 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide.
What is the SMILES notation for 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide?
The canonical SMILES for 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide is C=CC1=C(C=C)CN(/C(N)=N/C)CC1.
What is the InChIKey of 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide?
The InChIKey is BCMMLENAEWUQOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-4-9-6-7-14(11(12)13-3)8-10(9)5-2/h4-5H,1-2,6-8H2,3H3,(H2,12,13).
What are the key properties of 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide?
4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide has a molecular weight of 191.28 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(ethenyl)-N'-methyl-3,6-dihydro-2H-pyridine-1-carboximidamide is sourced from PubChem (CID 142863718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).