N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide

C12H15N3 — CID 177439354

IUPACN,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide
SMILESC=CCN(/C=N/c1ccccn1)CC=C
InChIInChI=1S/C12H15N3/c1-3-9-15(10-4-2)11-14-12-7-5-6-8-13-12/h3-8,11H,1-2,9-10H2/b14-11+
InChIKeyUAIGTHTVWPXOMG-SDNWHVSQSA-N
MW201.27 g/mol
LogP2.42
Rot. Bonds6

About N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide

N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide (PubChem CID 177439354) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide
PubChem CID177439354
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC NameN,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide
SMILESC=CCN(/C=N/c1ccccn1)CC=C
InChIInChI=1S/C12H15N3/c1-3-9-15(10-4-2)11-14-12-7-5-6-8-13-12/h3-8,11H,1-2,9-10H2/b14-11+
InChIKeyUAIGTHTVWPXOMG-SDNWHVSQSA-N
XLogP2.42
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

dipyridin-2-yldiazene;osmium
CID 173074203
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N-prop-2-enyl-N-pyridin-2-ylnitramide
CID 156698084
(3E)-1-(4-methylphenyl)-3-pyridin-2-yliminopropan-1-one
CID 91896388
(E)-3,3-diphenyl-N-pyridin-2-ylprop-2-en-1-imine
CID 177386351
(2-hydroxyphenyl)-bis(prop-2-enyl)-(pyridin-2-yldiazenyl)azanium
CID 70504326
(E)-4-oxo-4-[prop-2-enyl(pyridin-2-ylmethyl)amino]but-2-enoic acid
CID 39349109
2-diazenyl-N,N-bis(prop-2-enyl)pyridin-3-amine
CID 173388131
4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol
CID 135908107
2-penta-1,4-dienylpyridine
CID 66927735
1-(2-phenylmethoxyphenyl)-N-pyridin-2-ylmethanimine
CID 4779340

Frequently Asked Questions

What is the IUPAC name of N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide?
The IUPAC name of N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide (CID 177439354) is N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide.
What is the SMILES notation for N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide?
The canonical SMILES for N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide is C=CCN(/C=N/c1ccccn1)CC=C.
What is the InChIKey of N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide?
The InChIKey is UAIGTHTVWPXOMG-SDNWHVSQSA-N. The full InChI is InChI=1S/C12H15N3/c1-3-9-15(10-4-2)11-14-12-7-5-6-8-13-12/h3-8,11H,1-2,9-10H2/b14-11+.
What are the key properties of N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide?
N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide has a molecular weight of 201.27 g/mol, XLogP of 2.42, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)-N'-pyridin-2-ylmethanimidamide is sourced from PubChem (CID 177439354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).