4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine

C12H15N — CID 145372695

IUPAC4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine
SMILESC=C(/C=C\c1cnccc1C)CC
InChIInChI=1S/C12H15N/c1-4-10(2)5-6-12-9-13-8-7-11(12)3/h5-9H,2,4H2,1,3H3/b6-5-
InChIKeyYCBDQJIXZURAMG-WAYWQWQTSA-N
MW173.26 g/mol
LogP3.37
Rot. Bonds3

About 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine

4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine (PubChem CID 145372695) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine.

Molecular Properties

Compound Name4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine
PubChem CID145372695
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine
SMILESC=C(/C=C\c1cnccc1C)CC
InChIInChI=1S/C12H15N/c1-4-10(2)5-6-12-9-13-8-7-11(12)3/h5-9H,2,4H2,1,3H3/b6-5-
InChIKeyYCBDQJIXZURAMG-WAYWQWQTSA-N
XLogP3.37
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(NZ)-N-[(4-methyl-3-pyridinyl)methylidene]hydroxylamine
CID 5355244
3-[(1E)-2-ethenylpenta-1,4-dienyl]-4-methylpyridine
CID 134566553
4-methyl-3-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]pyridine
CID 57416520
(4-methyl-3-pyridinyl)methanimine
CID 89161625
N-(2-methylpropyl)-4-(4-methyl-3-pyridinyl)but-3-en-1-amine
CID 79598791
tert-butyl N-[4-(4-methyl-3-pyridinyl)but-3-enyl]carbamate
CID 170489930
(E)-2-amino-3-(4-methyl-3-pyridinyl)prop-2-enoic acid
CID 104830952
(E)-3-(4-methyl-3-pyridinyl)-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]prop-2-en-1-one
CID 167914731
[4-(pyridin-2-ylmethoxy)phenyl]methyl (E)-3-(4-methyl-3-pyridinyl)prop-2-enoate
CID 167814876
(E)-N,3-dimethyl-4-(4-methyl-3-pyridinyl)but-3-en-2-amine
CID 103092887
(Z)-2-ethyl-1-(4-methyl-3-pyridinyl)but-2-en-1-one
CID 103447311
(E)-3-(4-methyl-3-pyridinyl)-N-(2-phenylethyl)-N-(1,3-thiazol-2-yl)prop-2-enamide
CID 166209102

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine?
The IUPAC name of 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine (CID 145372695) is 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine.
What is the SMILES notation for 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine?
The canonical SMILES for 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine is C=C(/C=C\c1cnccc1C)CC.
What is the InChIKey of 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine?
The InChIKey is YCBDQJIXZURAMG-WAYWQWQTSA-N. The full InChI is InChI=1S/C12H15N/c1-4-10(2)5-6-12-9-13-8-7-11(12)3/h5-9H,2,4H2,1,3H3/b6-5-.
What are the key properties of 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine?
4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine has a molecular weight of 173.26 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[(Z)-3-methylidenepent-1-enyl]pyridine is sourced from PubChem (CID 145372695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).