4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine

C13H19NO3 — CID 91060133

IUPAC4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine
SMILESCc1nccc(OC[C@@H]2COC(C)(C)O2)c1C
InChIInChI=1S/C13H19NO3/c1-9-10(2)14-6-5-12(9)15-7-11-8-16-13(3,4)17-11/h5-6,11H,7-8H2,1-4H3/t11-/m1/s1
InChIKeyLSUVBMJOXJUKPD-LLVKDONJSA-N
MW237.30 g/mol
LogP2.23
Rot. Bonds3

About 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine

4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine (PubChem CID 91060133) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine.

Molecular Properties

Compound Name4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine
PubChem CID91060133
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine
SMILESCc1nccc(OC[C@@H]2COC(C)(C)O2)c1C
InChIInChI=1S/C13H19NO3/c1-9-10(2)14-6-5-12(9)15-7-11-8-16-13(3,4)17-11/h5-6,11H,7-8H2,1-4H3/t11-/m1/s1
InChIKeyLSUVBMJOXJUKPD-LLVKDONJSA-N
XLogP2.23
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine with MolForge

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Related Compounds

(4S)-2,2-dimethyl-4-[(2-methylphenoxy)methyl]-1,3-dioxolane
CID 71365815
2,2-dimethyl-4-[(4-methylphenoxy)methyl]-1,3-dioxolane
CID 66834871
2-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]pyridine
CID 10420609
3,6-dichloro-4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]pyridazine
CID 87485818
4-[(2-tert-butyl-4-methylphenoxy)methyl]-2,2-dimethyl-1,3-dioxolane
CID 68913818
(4R)-2,2-dimethyl-4-[[2-methyl-4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenoxy]methyl]-1,3-dioxolane
CID 162603257
2-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]pyridine-4-carboxylic acid
CID 58477311
[2-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-3-pyridinyl]methanol
CID 126708776
4-chloro-2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]benzonitrile
CID 10706967
3-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]aniline
CID 58278984
4-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-5-fluorobenzene-1,2-diamine
CID 178075892
5-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]pyridin-2-amine
CID 121350448

Frequently Asked Questions

What is the IUPAC name of 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine?
The IUPAC name of 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine (CID 91060133) is 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine.
What is the SMILES notation for 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine?
The canonical SMILES for 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine is Cc1nccc(OC[C@@H]2COC(C)(C)O2)c1C.
What is the InChIKey of 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine?
The InChIKey is LSUVBMJOXJUKPD-LLVKDONJSA-N. The full InChI is InChI=1S/C13H19NO3/c1-9-10(2)14-6-5-12(9)15-7-11-8-16-13(3,4)17-11/h5-6,11H,7-8H2,1-4H3/t11-/m1/s1.
What are the key properties of 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine?
4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine has a molecular weight of 237.30 g/mol, XLogP of 2.23, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]-2,3-dimethylpyridine is sourced from PubChem (CID 91060133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).