(2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine

C14H21NO — CID 164585039

IUPAC(2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine
SMILESC/C=C1/C=C(OC)C=CN1/C(C)=C(\C)CC
InChIInChI=1S/C14H21NO/c1-6-11(3)12(4)15-9-8-14(16-5)10-13(15)7-2/h7-10H,6H2,1-5H3/b12-11+,13-7-
InChIKeyIELLTTXVBOVJAK-UYTHXWSBSA-N
MW219.33 g/mol
LogP3.95
Rot. Bonds3

About (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine

(2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine (PubChem CID 164585039) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine.

Molecular Properties

Compound Name(2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine
PubChem CID164585039
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name(2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine
SMILESC/C=C1/C=C(OC)C=CN1/C(C)=C(\C)CC
InChIInChI=1S/C14H21NO/c1-6-11(3)12(4)15-9-8-14(16-5)10-13(15)7-2/h7-10H,6H2,1-5H3/b12-11+,13-7-
InChIKeyIELLTTXVBOVJAK-UYTHXWSBSA-N
XLogP3.95
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-Fluoro-2-methylidenehexa-3,5-dienoxy)-1,5-dimethyl-2-methylidenepyridine
CID 123792333
(2Z,5E)-N-(fluoromethyl)-5-methoxy-N-methyl-4-methylideneocta-2,5,7-trien-2-amine
CID 166906897
2,2-Dimethyl-4,6-bis(diethylamino)pyran
CID 129742101
3-Methoxy-5-methyl-2-methylidene-1-(2,2,2-trifluoroethyl)pyridine
CID 157089353
1-(2,2-Difluoroethyl)-3-methoxy-5-methyl-2-methylidenepyridine
CID 162194484
(2E,4Z)-N-ethyl-4-methoxy-N,6,7-trimethylocta-2,4,6-trien-1-amine
CID 54571566
15,17,21,23,29,35-Hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-1(35),2,5,7,9,13,15,17,19,21,23,25,27,29,31,33-hexadecaene
CID 91579694
6-methoxy-N,N,4-trimethylhepta-2,4,6-trien-2-amine
CID 123158046
2-methoxy-1,5,6-trimethyl-2H-pyridine
CID 123225410
6-ethylidene-3-methoxy-N,N-dimethyl-5-methylidenecyclohexa-1,3-dien-1-amine
CID 123475527
4-methoxy-N,3-dimethyl-N-penta-1,3-dien-2-ylpent-3-en-1-amine
CID 123491650
N-ethyl-6-methoxy-N-methyl-4-methylidenehepta-2,5-dien-2-amine
CID 123792144

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine?
The IUPAC name of (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine (CID 164585039) is (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine.
What is the SMILES notation for (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine?
The canonical SMILES for (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine is C/C=C1/C=C(OC)C=CN1/C(C)=C(\C)CC.
What is the InChIKey of (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine?
The InChIKey is IELLTTXVBOVJAK-UYTHXWSBSA-N. The full InChI is InChI=1S/C14H21NO/c1-6-11(3)12(4)15-9-8-14(16-5)10-13(15)7-2/h7-10H,6H2,1-5H3/b12-11+,13-7-.
What are the key properties of (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine?
(2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine has a molecular weight of 219.33 g/mol, XLogP of 3.95, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-ethylidene-4-methoxy-1-[(E)-3-methylpent-2-en-2-yl]pyridine is sourced from PubChem (CID 164585039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).