2-methyl-1,3-dioxolane;4-propan-2-ylpyridine

C12H19NO2 — CID 167569960

IUPAC2-methyl-1,3-dioxolane;4-propan-2-ylpyridine
SMILESCC(C)c1ccncc1.CC1OCCO1
InChIInChI=1S/C8H11N.C4H8O2/c1-7(2)8-3-5-9-6-4-8;1-4-5-2-3-6-4/h3-7H,1-2H3;4H,2-3H2,1H3
InChIKeyFTTVDLPKFNWSCU-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.58
Rot. Bonds1

About 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine

2-methyl-1,3-dioxolane;4-propan-2-ylpyridine (PubChem CID 167569960) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine.

Molecular Properties

Compound Name2-methyl-1,3-dioxolane;4-propan-2-ylpyridine
PubChem CID167569960
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name2-methyl-1,3-dioxolane;4-propan-2-ylpyridine
SMILESCC(C)c1ccncc1.CC1OCCO1
InChIInChI=1S/C8H11N.C4H8O2/c1-7(2)8-3-5-9-6-4-8;1-4-5-2-3-6-4/h3-7H,1-2H3;4H,2-3H2,1H3
InChIKeyFTTVDLPKFNWSCU-UHFFFAOYSA-N
XLogP2.58
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

tris(4-propan-2-ylpyridine);trichlorochromium
CID 19688799
1-(4-propan-2-ylphenyl)-N-[(1R)-1-pyridin-4-ylethyl]ethanamine
CID 81406241
(1R)-1-pyridin-4-ylethanethiol
CID 92977193
2-deuterio-4-propan-2-ylpyridine
CID 175918465
1-methyl-4-propan-2-ylpyrazole;4-propan-2-ylpyridine
CID 163486860
2-(1,3-dioxolan-2-yl)-1-pyridin-4-ylethanol
CID 59574538
methane;3-propan-2-ylpyridine;4-propan-2-ylpyridine
CID 177028413
N-[(1S)-1-pyridin-4-ylethyl]oxan-4-amine
CID 81405595
dimethyl(phenyl)borane;4-propan-2-ylpyridine
CID 68614411
ethane;2-propan-2-ylpyridine;4-propan-2-ylpyridine
CID 159031608
3-methyl-N-[(1S)-1-pyridin-4-ylethyl]cyclobutan-1-amine
CID 103562196
1-(5-methyloxolan-2-yl)-2-pyridin-4-ylpropan-1-ol
CID 81327989

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine?
The IUPAC name of 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine (CID 167569960) is 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine.
What is the SMILES notation for 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine?
The canonical SMILES for 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine is CC(C)c1ccncc1.CC1OCCO1.
What is the InChIKey of 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine?
The InChIKey is FTTVDLPKFNWSCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.C4H8O2/c1-7(2)8-3-5-9-6-4-8;1-4-5-2-3-6-4/h3-7H,1-2H3;4H,2-3H2,1H3.
What are the key properties of 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine?
2-methyl-1,3-dioxolane;4-propan-2-ylpyridine has a molecular weight of 209.29 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,3-dioxolane;4-propan-2-ylpyridine is sourced from PubChem (CID 167569960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).