(2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine

C15H25N3 — CID 138711921

IUPAC(2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine
SMILESC/C=C1\C/C(=C\CN)N(C)C=C1C1CCNCC1
InChIInChI=1S/C15H25N3/c1-3-12-10-14(4-7-16)18(2)11-15(12)13-5-8-17-9-6-13/h3-4,11,13,17H,5-10,16H2,1-2H3/b12-3+,14-4+
InChIKeyRDKSXGVDYFDSEN-KDQHTWITSA-N
MW247.39 g/mol
LogP1.99
Rot. Bonds2

About (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine

(2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine (PubChem CID 138711921) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine.

Molecular Properties

Compound Name(2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine
PubChem CID138711921
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name(2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine
SMILESC/C=C1\C/C(=C\CN)N(C)C=C1C1CCNCC1
InChIInChI=1S/C15H25N3/c1-3-12-10-14(4-7-16)18(2)11-15(12)13-5-8-17-9-6-13/h3-4,11,13,17H,5-10,16H2,1-2H3/b12-3+,14-4+
InChIKeyRDKSXGVDYFDSEN-KDQHTWITSA-N
XLogP1.99
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine with MolForge

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Related Compounds

Octahydro 4,4'-bipyridyl
CID 4867470
2-[2-(Fluoromethyl)piperidin-4-yl]-1,2-dihydropyridine
CID 69107961
5-fluoro-3-[(1-methylpiperidin-4-yl)methyl]-3a,7a-dihydro-1H-indole
CID 70921115
N-[(5Z,6E)-3-[(E)-6-amino-6-fluoro-5-methylhex-5-en-3-yl]-6-(aminomethylidene)-5-prop-2-enylidenecyclohexa-1,3-dien-1-yl]piperidin-4-amine
CID 89085395
5-fluoro-2-[1-(6-methylpiperidin-3-yl)ethylidene]-1H-pyridine
CID 123278977
5-fluoro-3-(1-propan-2-ylpiperidin-4-yl)-5,6-dihydro-1H-indole
CID 123995432
4-Fluoro-4-(1-methylpiperidin-4-yl)cyclohexa-1,5-dien-1-amine
CID 152035661
2,6-difluoro-1-methyl-5-(2-methylpiperidin-2-yl)-2H-pyridin-4-amine
CID 163635316
4-Methylenetetrahydro-quinoline
CID 129787483
4-[4-[Ethyl(methyl)amino]butan-2-yl]-3-fluorocyclohexa-1,3-dien-1-amine
CID 144296077
6-Fluoro-6-methyl-3-(1-propylpiperidin-4-yl)-1,5-dihydroindole
CID 144855194
(2Z)-2-ethylidene-5-[(4-fluoro-4-methylpiperidin-1-yl)methyl]-3-methyl-1H-pyridine
CID 166080082

Frequently Asked Questions

What is the IUPAC name of (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine?
The IUPAC name of (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine (CID 138711921) is (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine.
What is the SMILES notation for (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine?
The canonical SMILES for (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine is C/C=C1\C/C(=C\CN)N(C)C=C1C1CCNCC1.
What is the InChIKey of (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine?
The InChIKey is RDKSXGVDYFDSEN-KDQHTWITSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-12-10-14(4-7-16)18(2)11-15(12)13-5-8-17-9-6-13/h3-4,11,13,17H,5-10,16H2,1-2H3/b12-3+,14-4+.
What are the key properties of (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine?
(2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine has a molecular weight of 247.39 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(4E)-4-ethylidene-1-methyl-5-piperidin-4-yl-2-pyridinylidene]ethanamine is sourced from PubChem (CID 138711921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).