(2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine

C13H17NO — CID 166972950

IUPAC(2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine
SMILESCC/C=C(C)\C=c1\cccn\c1=C/OC
InChIInChI=1S/C13H17NO/c1-4-6-11(2)9-12-7-5-8-14-13(12)10-15-3/h5-10H,4H2,1-3H3/b11-6-,12-9-,13-10-
InChIKeyXDSCCRYWATXKAO-QSEBSJSGSA-N
MW203.28 g/mol
LogP1.60
Rot. Bonds3

About (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine

(2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine (PubChem CID 166972950) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine.

Molecular Properties

Compound Name(2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine
PubChem CID166972950
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name(2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine
SMILESCC/C=C(C)\C=c1\cccn\c1=C/OC
InChIInChI=1S/C13H17NO/c1-4-6-11(2)9-12-7-5-8-14-13(12)10-15-3/h5-10H,4H2,1-3H3/b11-6-,12-9-,13-10-
InChIKeyXDSCCRYWATXKAO-QSEBSJSGSA-N
XLogP1.60
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5Z,6Z)-5-ethylidene-6-[(E)-2-methylpent-2-enylidene]cyclohexa-1,3-diene
CID 162733287
3-ethylidene-2-(2-methylbut-2-enylidene)pyridine
CID 90959337
2-[(Z)-pent-2-en-2-yl]pyridine
CID 45079825
ethane;3-[(E)-hex-3-en-3-yl]-2-(trifluoromethyl)pyridine
CID 153372825
(2E,3Z)-3-[(Z)-but-2-enylidene]-2-ethylidenepyridine
CID 130370242
ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyridine
CID 142972372
(2Z,3Z)-2-(1-ethoxypropylidene)-3-ethylidenepyridine
CID 142189103
3-ethoxy-N-(3-methylbut-2-enyl)pyridin-2-amine
CID 106191598
1,8-naphthyridine;propane
CID 142433930
N-[(E)-1-(3-methoxy-2-pyridinyl)pent-2-en-2-yl]-1,3,4-thiadiazol-2-amine
CID 144630671
1-(3-hydroxy-2-pyridinyl)ethanone;methyl formate
CID 142181974
ethane;2-[(2Z,4E)-hepta-2,4-dien-4-yl]pyridine
CID 145320713

Frequently Asked Questions

What is the IUPAC name of (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine?
The IUPAC name of (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine (CID 166972950) is (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine.
What is the SMILES notation for (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine?
The canonical SMILES for (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine is CC/C=C(C)\C=c1\cccn\c1=C/OC.
What is the InChIKey of (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine?
The InChIKey is XDSCCRYWATXKAO-QSEBSJSGSA-N. The full InChI is InChI=1S/C13H17NO/c1-4-6-11(2)9-12-7-5-8-14-13(12)10-15-3/h5-10H,4H2,1-3H3/b11-6-,12-9-,13-10-.
What are the key properties of (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine?
(2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine has a molecular weight of 203.28 g/mol, XLogP of 1.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,3Z)-2-(methoxymethylidene)-3-[(Z)-2-methylpent-2-enylidene]pyridine is sourced from PubChem (CID 166972950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).