5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine

C12H17N — CID 146203799

IUPAC5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine
SMILESC=C(C)c1ccc(CC(C)C)cn1
InChIInChI=1S/C12H17N/c1-9(2)7-11-5-6-12(10(3)4)13-8-11/h5-6,8-9H,3,7H2,1-2,4H3
InChIKeyYNHYTLIMAXLEMD-UHFFFAOYSA-N
MW175.27 g/mol
LogP3.31
Rot. Bonds3

About 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine

5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine (PubChem CID 146203799) has the molecular formula C12H17N and a molecular weight of 175.27 g/mol. Its IUPAC name is 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine.

Molecular Properties

Compound Name5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine
PubChem CID146203799
Molecular FormulaC12H17N
Molecular Weight175.27 g/mol
Exact Mass175.14
IUPAC Name5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine
SMILESC=C(C)c1ccc(CC(C)C)cn1
InChIInChI=1S/C12H17N/c1-9(2)7-11-5-6-12(10(3)4)13-8-11/h5-6,8-9H,3,7H2,1-2,4H3
InChIKeyYNHYTLIMAXLEMD-UHFFFAOYSA-N
XLogP3.31
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

aminomethyl (2Z)-N-amino-5-(2-methylpropyl)pyridine-2-carboximidothioate
CID 143241201
5-methyl-1-[5-(2-methylpropyl)-2-pyridinyl]hexane-1,3-dione
CID 123498845
1-(2-methylpropyl)-4-prop-1-en-2-ylbenzene
CID 10176333
1-(6-prop-1-en-2-yl-3-pyridinyl)ethanol
CID 144950650
ethane;1-(2-methylpropyl)-4-prop-1-en-2-ylbenzene
CID 144516269
1-hydroxy-5-methyl-1-[5-(2-methylpropyl)-2-pyridinyl]hex-1-en-3-one
CID 154009707
5-methyl-4-(2-methylpropyl)-2-prop-1-en-2-ylpyridine
CID 166972644
methane;5-(2-methylpropyl)-2-propan-2-ylpyridine
CID 158292296
2-ethyl-5-(2-methylpropyl)pyridine
CID 126548709
6-prop-1-en-2-ylpyridin-3-amine
CID 66520228
2-(4-methylphenyl)-5-(2-methylpropyl)pyridine
CID 71106004
(2S)-3-(6-acetyl-3-pyridinyl)-2-aminopropanoic acid
CID 170110433

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine?
The IUPAC name of 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine (CID 146203799) is 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine.
What is the SMILES notation for 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine?
The canonical SMILES for 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine is C=C(C)c1ccc(CC(C)C)cn1.
What is the InChIKey of 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine?
The InChIKey is YNHYTLIMAXLEMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-9(2)7-11-5-6-12(10(3)4)13-8-11/h5-6,8-9H,3,7H2,1-2,4H3.
What are the key properties of 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine?
5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine has a molecular weight of 175.27 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-2-prop-1-en-2-ylpyridine is sourced from PubChem (CID 146203799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).