6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine

C12H19N3 — CID 177040450

IUPAC6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine
SMILESCCC/C=C(C)/N=c1\ccc(N)cn1C
InChIInChI=1S/C12H19N3/c1-4-5-6-10(2)14-12-8-7-11(13)9-15(12)3/h6-9H,4-5,13H2,1-3H3/b10-6+,14-12+
InChIKeyPZJOFOOINQMTJH-LYZYBJJASA-N
MW205.30 g/mol
LogP2.21
Rot. Bonds3

About 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine

6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine (PubChem CID 177040450) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine.

Molecular Properties

Compound Name6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine
PubChem CID177040450
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine
SMILESCCC/C=C(C)/N=c1\ccc(N)cn1C
InChIInChI=1S/C12H19N3/c1-4-5-6-10(2)14-12-8-7-11(13)9-15(12)3/h6-9H,4-5,13H2,1-3H3/b10-6+,14-12+
InChIKeyPZJOFOOINQMTJH-LYZYBJJASA-N
XLogP2.21
TPSA43.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

p-(1-Dimethylamino ethylimino)aniline
CID 129852262
4-fluoro-1-methyl-6-[(E)-pent-1-enyl]iminopyridin-3-amine
CID 177040741
N-ethenyl-5-ethyl-1-methylpyridin-2-imine
CID 89142774
(Z)-N'-[(1Z)-hexa-1,3-dienyl]but-2-enimidamide
CID 91013982
N'-cyclohexa-2,4-dien-1-yl-N-ethenylethanimidamide
CID 91616301
4-ethyl-2-methyl-6-[(1Z)-penta-1,3-dienyl]-1,4-dihydropyrimidine
CID 123186985
(5Z,6E)-5-(dimethylaminomethylidene)-6-ethylidenepyridin-2-amine
CID 129301168
(Z)-N-[(1E)-buta-1,3-dienyl]-N'-methyl-5-(methylamino)hex-2-enimidamide
CID 129302968
1-Ethenyl-2-methyliminopyridin-4-amine
CID 142337019
ethane;N-ethenyl-4-ethyl-1-methylpyridin-2-imine
CID 142456423
1-ethenyl-5-ethyl-N-methylpyridin-2-imine
CID 142917596
ethane;(2Z,4E)-4-[(E)-2-(5-methyl-2-methylimino-1-pyridinyl)ethenyl]hexa-2,4-dien-1-amine
CID 142947862

Frequently Asked Questions

What is the IUPAC name of 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine?
The IUPAC name of 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine (CID 177040450) is 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine.
What is the SMILES notation for 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine?
The canonical SMILES for 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine is CCC/C=C(C)/N=c1\ccc(N)cn1C.
What is the InChIKey of 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine?
The InChIKey is PZJOFOOINQMTJH-LYZYBJJASA-N. The full InChI is InChI=1S/C12H19N3/c1-4-5-6-10(2)14-12-8-7-11(13)9-15(12)3/h6-9H,4-5,13H2,1-3H3/b10-6+,14-12+.
What are the key properties of 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine?
6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine has a molecular weight of 205.30 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(E)-hex-2-en-2-yl]imino-1-methylpyridin-3-amine is sourced from PubChem (CID 177040450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).