(Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane

C24H36ClN — CID 143032201

IUPAC(Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane
SMILESC/C=C\C.C=C(C)c1ccc(-c2ncccc2Cl)c(C)c1.CC.CCC
InChIInChI=1S/C15H14ClN.C4H8.C3H8.C2H6/c1-10(2)12-6-7-13(11(3)9-12)15-14(16)5-4-8-17-15;1-3-4-2;1-3-2;1-2/h4-9H,1H2,2-3H3;3-4H,1-2H3;3H2,1-2H3;1-2H3/b;4-3-;;
InChIKeyHDGDLMGRNOPFLR-MECAPONASA-N
MW374.01 g/mol
LogP8.77
Rot. Bonds2

About (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane

(Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane (PubChem CID 143032201) has the molecular formula C24H36ClN and a molecular weight of 374.01 g/mol. Its IUPAC name is (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane.

Molecular Properties

Compound Name(Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane
PubChem CID143032201
Molecular FormulaC24H36ClN
Molecular Weight374.01 g/mol
Exact Mass373.25
IUPAC Name(Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane
SMILESC/C=C\C.C=C(C)c1ccc(-c2ncccc2Cl)c(C)c1.CC.CCC
InChIInChI=1S/C15H14ClN.C4H8.C3H8.C2H6/c1-10(2)12-6-7-13(11(3)9-12)15-14(16)5-4-8-17-15;1-3-4-2;1-3-2;1-2/h4-9H,1H2,2-3H3;3-4H,1-2H3;3H2,1-2H3;1-2H3/b;4-3-;;
InChIKeyHDGDLMGRNOPFLR-MECAPONASA-N
XLogP8.77
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.01
LogP ≤ 58.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(2-fluoro-4-prop-1-en-2-ylphenyl)-3-methylpyridine
CID 143030309
2-(2-ethyl-4-prop-1-en-2-ylphenyl)-3-methylpyridine;methylcyclopropane
CID 143032513
3-chloro-4-(3-chloro-2-pyridinyl)benzoic acid
CID 68947647
4-(3-chloro-2-pyridinyl)-3-fluorobenzoic acid
CID 69201249
3-chloro-2-(3-chloro-2-pyridinyl)pyridine;palladium(2+)
CID 18935247
N-(4-acetamidophenyl)-4-(3-chloro-2-pyridinyl)-3-fluorobenzamide
CID 59673213
1-chloro-3-methyl-2-prop-1-en-2-ylbenzene;propane
CID 163302600
2-(2-methyl-4-prop-1-en-2-ylphenyl)benzonitrile
CID 143621537
methyl 8-(3-chloro-2-pyridinyl)naphthalene-2-carboxylate
CID 58553621
ethane;2-methyl-4-prop-1-en-2-ylpyridine
CID 166484279
4-(3-chloro-2-pyridinyl)-N-ethylbenzamide
CID 59673494
1-(methoxymethoxy)-2-methyl-4-prop-1-en-2-ylbenzene
CID 18413679

Frequently Asked Questions

What is the IUPAC name of (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane?
The IUPAC name of (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane (CID 143032201) is (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane.
What is the SMILES notation for (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane?
The canonical SMILES for (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane is C/C=C\C.C=C(C)c1ccc(-c2ncccc2Cl)c(C)c1.CC.CCC.
What is the InChIKey of (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane?
The InChIKey is HDGDLMGRNOPFLR-MECAPONASA-N. The full InChI is InChI=1S/C15H14ClN.C4H8.C3H8.C2H6/c1-10(2)12-6-7-13(11(3)9-12)15-14(16)5-4-8-17-15;1-3-4-2;1-3-2;1-2/h4-9H,1H2,2-3H3;3-4H,1-2H3;3H2,1-2H3;1-2H3/b;4-3-;;.
What are the key properties of (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane?
(Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane has a molecular weight of 374.01 g/mol, XLogP of 8.77, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-but-2-ene;3-chloro-2-(2-methyl-4-prop-1-en-2-ylphenyl)pyridine;ethane;propane is sourced from PubChem (CID 143032201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).