2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine

C16H23N3 — CID 156819137

IUPAC2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine
SMILESC=C(/C=c1/nc(N2CCCCC2)cc/c1=C/C)CN
InChIInChI=1S/C16H23N3/c1-3-14-7-8-16(19-9-5-4-6-10-19)18-15(14)11-13(2)12-17/h3,7-8,11H,2,4-6,9-10,12,17H2,1H3/b14-3-,15-11+
InChIKeyGHFNFQSULFCYBX-WYWOMNKFSA-N
MW257.38 g/mol
LogP1.17
Rot. Bonds3

About 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine

2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine (PubChem CID 156819137) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine.

Molecular Properties

Compound Name2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine
PubChem CID156819137
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC Name2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine
SMILESC=C(/C=c1/nc(N2CCCCC2)cc/c1=C/C)CN
InChIInChI=1S/C16H23N3/c1-3-14-7-8-16(19-9-5-4-6-10-19)18-15(14)11-13(2)12-17/h3,7-8,11H,2,4-6,9-10,12,17H2,1H3/b14-3-,15-11+
InChIKeyGHFNFQSULFCYBX-WYWOMNKFSA-N
XLogP1.17
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine with MolForge

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Related Compounds

2-(2-Methyl-4-methylidene-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-3-yl)ethanamine
CID 67554552
1-(4-Methyl-5,6-dimethylidene-2-pyridinyl)piperazine
CID 123234443
1-But-1-en-2-yl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridin-2-imine
CID 123811988
(E)-6-amino-3-methyl-N'-[(3Z)-6-methylhepta-1,3,6-trien-2-yl]-N-(2-propan-2-ylhexa-2,4-dienyl)-N-propylhex-2-enimidamide
CID 123824883
ethane;N-[(2Z,4E)-3-methylhexa-2,4-dien-2-yl]-1-piperidin-1-ylethanimine
CID 142064525
5-ethenyl-6-methylidene-2-(1-methylpiperidin-4-yl)-4-prop-1-en-2-yl-1H-pyrimidine
CID 142187236
(2E)-1-(C,N-dimethylcarbonimidoyl)-5-methyl-N-(1-methylpiperidin-4-yl)-2-propylidenepyridin-3-amine
CID 142345339
4-(1-aminoethenyl)-N,3-dimethyl-N-(1-methylpiperidin-4-yl)-2,3-dihydropyridin-6-amine;molecular hydrogen
CID 142583556
Methane;1-[3-methyl-6-[4-(2-methylpropyl)piperidin-1-yl]-2,3-dihydropyridin-4-yl]ethenamine;molecular hydrogen
CID 142583905
1-[(5Z,6E)-5-ethylidene-6-prop-2-enylidene-2-pyridinyl]piperazine
CID 156377873
2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-enenitrile
CID 156819082
(3E)-4-[(4-methyl-2H-pyrido[1,2-a]pyrimidin-2-yl)methyl]hexa-1,3,5-trien-3-amine
CID 161565542

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine?
The IUPAC name of 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine (CID 156819137) is 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine.
What is the SMILES notation for 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine?
The canonical SMILES for 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine is C=C(/C=c1/nc(N2CCCCC2)cc/c1=C/C)CN.
What is the InChIKey of 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine?
The InChIKey is GHFNFQSULFCYBX-WYWOMNKFSA-N. The full InChI is InChI=1S/C16H23N3/c1-3-14-7-8-16(19-9-5-4-6-10-19)18-15(14)11-13(2)12-17/h3,7-8,11H,2,4-6,9-10,12,17H2,1H3/b14-3-,15-11+.
What are the key properties of 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine?
2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine has a molecular weight of 257.38 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-[(3Z)-3-ethylidene-6-piperidin-1-yl-2-pyridinylidene]methyl]prop-2-en-1-amine is sourced from PubChem (CID 156819137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).