2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide

C14H22N2O — CID 143566735

IUPAC2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide
SMILESC/C=C\C(C1=CCN(CC(N)=O)CC1)=C(C)C
InChIInChI=1S/C14H22N2O/c1-4-5-13(11(2)3)12-6-8-16(9-7-12)10-14(15)17/h4-6H,7-10H2,1-3H3,(H2,15,17)/b5-4-
InChIKeyGYZZTFYJPMFUPF-PLNGDYQASA-N
MW234.34 g/mol
LogP2.02
Rot. Bonds4

About 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide

2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide (PubChem CID 143566735) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide
PubChem CID143566735
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide
SMILESC/C=C\C(C1=CCN(CC(N)=O)CC1)=C(C)C
InChIInChI=1S/C14H22N2O/c1-4-5-13(11(2)3)12-6-8-16(9-7-12)10-14(15)17/h4-6H,7-10H2,1-3H3,(H2,15,17)/b5-4-
InChIKeyGYZZTFYJPMFUPF-PLNGDYQASA-N
XLogP2.02
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

1,1,4-trimethyl-3,6-dihydro-2H-pyridin-1-ium-2-carboxamide iodide
CID 24199603
2-(diethylamino)-N-(1,2-dimethylcyclohexa-2,4-dien-1-yl)acetamide
CID 89553693
2-(dimethylamino)-1-(4-methylidene-3,7-dihydro-2H-azepin-1-yl)ethanone
CID 117659398
2-[4-(2-Methylidenehexa-3,5-dienyl)piperazin-1-yl]acetamide
CID 123371564
2-(diethylamino)-N-(2,6-dimethylhepta-2,4,6-trienyl)acetamide
CID 123468915
2-(dimethylamino)-N-(3,4-dimethylcyclohexa-1,3-dien-1-yl)acetamide
CID 123961968
2-(diethylamino)-N-(2,6-dimethylcyclohexa-1,5-dien-1-yl)acetamide
CID 130180953
1-formyl-4,5-bis[(Z)-prop-1-enyl]-3,6-dihydro-2H-pyridine-2-carboxamide
CID 130371631
N-methyl-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)acetamide
CID 130650283
(5Z)-6-methyl-4-prop-2-enyl-3,7,10,11-tetrahydro-1H-1,4-benzodiazonin-2-one
CID 135161153
N-[2-(diethylamino)ethyl]-2,3,4,5-tetrahydro-1H-isoindole-1-carboxamide
CID 141045690
2-[cyclohexa-1,3-dien-1-ylmethyl(methyl)amino]-N-methylacetamide
CID 142143283

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide?
The IUPAC name of 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide (CID 143566735) is 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide is C/C=C\C(C1=CCN(CC(N)=O)CC1)=C(C)C.
What is the InChIKey of 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide?
The InChIKey is GYZZTFYJPMFUPF-PLNGDYQASA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-5-13(11(2)3)12-6-8-16(9-7-12)10-14(15)17/h4-6H,7-10H2,1-3H3,(H2,15,17)/b5-4-.
What are the key properties of 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide?
2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide has a molecular weight of 234.34 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4Z)-2-methylhexa-2,4-dien-3-yl]-3,6-dihydro-2H-pyridin-1-yl]acetamide is sourced from PubChem (CID 143566735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).