6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine

C9H14N2O — CID 130260620

IUPAC6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
SMILESCC(C)N1CCc2cnoc2C1
InChIInChI=1S/C9H14N2O/c1-7(2)11-4-3-8-5-10-12-9(8)6-11/h5,7H,3-4,6H2,1-2H3
InChIKeyRPLLPKKMFXDGNZ-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.44
Rot. Bonds1

About 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine

6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine (PubChem CID 130260620) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine.

Molecular Properties

Compound Name6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
PubChem CID130260620
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
SMILESCC(C)N1CCc2cnoc2C1
InChIInChI=1S/C9H14N2O/c1-7(2)11-4-3-8-5-10-12-9(8)6-11/h5,7H,3-4,6H2,1-2H3
InChIKeyRPLLPKKMFXDGNZ-UHFFFAOYSA-N
XLogP1.44
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4,5,6,7-Tetrahydroisoxazolo[5,4-c]pyridine
CID 20581451
4H,5H,6H,7H-[1,2]oxazolo[5,4-c]pyridine hydrochloride
CID 154857197
3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
CID 145046782
5-ethyl-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine
CID 58157197
5-methyl-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine
CID 58863298
5-propan-2-yl-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine
CID 67986580
1,1-dimethylethyl 4,7-dihydro-4-(hydroxyimino)-isoxazolo[5,4-c]pyridine-6(5H)-carboxylate
CID 86601367
4,5,6,7-Tetrahydro-4-[(2-propenyloxy)amino]-isoxazolo[5,4-c]pyridine
CID 86601368
tert-butyl (4Z)-4-hydroxyimino-5,7-dihydro-[1,2]oxazolo[5,4-c]pyridine-6-carboxylate
CID 87793588
(4Z)-4-hydroxyimino-5,7-dihydro-[1,2]oxazolo[5,4-c]pyridine-6-carboxylic acid
CID 87801356
6-tert-butyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
CID 89079762
6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
CID 89225224

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine?
The IUPAC name of 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine (CID 130260620) is 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine.
What is the SMILES notation for 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine?
The canonical SMILES for 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine is CC(C)N1CCc2cnoc2C1.
What is the InChIKey of 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine?
The InChIKey is RPLLPKKMFXDGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7(2)11-4-3-8-5-10-12-9(8)6-11/h5,7H,3-4,6H2,1-2H3.
What are the key properties of 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine?
6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine has a molecular weight of 166.22 g/mol, XLogP of 1.44, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine is sourced from PubChem (CID 130260620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).