(2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine

C12H23NO — CID 131847789

IUPAC(2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine
SMILESCC(C)[C@H]1CO[C@H](C2CCCCC2)N1
InChIInChI=1S/C12H23NO/c1-9(2)11-8-14-12(13-11)10-6-4-3-5-7-10/h9-13H,3-8H2,1-2H3/t11-,12-/m1/s1
InChIKeyRUNJCYLUOIHLRM-VXGBXAGGSA-N
MW197.32 g/mol
LogP2.54
Rot. Bonds2

About (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine

(2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine (PubChem CID 131847789) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine.

Molecular Properties

Compound Name(2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine
PubChem CID131847789
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name(2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine
SMILESCC(C)[C@H]1CO[C@H](C2CCCCC2)N1
InChIInChI=1S/C12H23NO/c1-9(2)11-8-14-12(13-11)10-6-4-3-5-7-10/h9-13H,3-8H2,1-2H3/t11-,12-/m1/s1
InChIKeyRUNJCYLUOIHLRM-VXGBXAGGSA-N
XLogP2.54
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-2,4-di(propan-2-yl)-1,3-oxazolidine
CID 22951232
2-cyclohexyl-5-methyl-1,3-oxazinane;hydrochloride
CID 117227184
4-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane
CID 176647402
4-methyl-2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazolidine;hydrochloride
CID 117227683
(3S,4aS,8aS)-3-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline
CID 59913049
(2S,6S)-2,6-di(propan-2-yl)piperidine;methane
CID 157197776
(2R)-2-propan-2-ylazepane
CID 7048221
3-propan-2-yl-3,4,4a,5,7,7a-hexahydro-2H-thieno[3,4-b][1,4]oxazine 6,6-dioxide
CID 115277838
2-cyclohexyl-1,3-oxazolidine
CID 117225833
4-methyl-2-(oxan-3-yl)-1,3-oxazolidine;hydrochloride
CID 117227809
2-cyclohexyl-1-methyl-5-propan-2-ylpiperazine
CID 64840220
3-(2-methylpropyl)-2-propan-2-yl-1,2,3,5,5a,6,7,8,9,9a-decahydrobenzo[e][1,4]oxazepine
CID 106364304

Frequently Asked Questions

What is the IUPAC name of (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine?
The IUPAC name of (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine (CID 131847789) is (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine.
What is the SMILES notation for (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine?
The canonical SMILES for (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine is CC(C)[C@H]1CO[C@H](C2CCCCC2)N1.
What is the InChIKey of (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine?
The InChIKey is RUNJCYLUOIHLRM-VXGBXAGGSA-N. The full InChI is InChI=1S/C12H23NO/c1-9(2)11-8-14-12(13-11)10-6-4-3-5-7-10/h9-13H,3-8H2,1-2H3/t11-,12-/m1/s1.
What are the key properties of (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine?
(2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine has a molecular weight of 197.32 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S)-2-cyclohexyl-4-propan-2-yl-1,3-oxazolidine is sourced from PubChem (CID 131847789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).