(2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine

C17H29N3O2 — CID 95486281

IUPAC(2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine
SMILESCC(C)c1nnc(CN2CCO[C@H](CC3CCCCC3)C2)o1
InChIInChI=1S/C17H29N3O2/c1-13(2)17-19-18-16(22-17)12-20-8-9-21-15(11-20)10-14-6-4-3-5-7-14/h13-15H,3-12H2,1-2H3/t15-/m1/s1
InChIKeyUXZRSRQFWDFUEC-OAHLLOKOSA-N
MW307.44 g/mol
LogP3.36
Rot. Bonds5

About (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine

(2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine (PubChem CID 95486281) has the molecular formula C17H29N3O2 and a molecular weight of 307.44 g/mol. Its IUPAC name is (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine.

Molecular Properties

Compound Name(2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine
PubChem CID95486281
Molecular FormulaC17H29N3O2
Molecular Weight307.44 g/mol
Exact Mass307.23
IUPAC Name(2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine
SMILESCC(C)c1nnc(CN2CCO[C@H](CC3CCCCC3)C2)o1
InChIInChI=1S/C17H29N3O2/c1-13(2)17-19-18-16(22-17)12-20-8-9-21-15(11-20)10-14-6-4-3-5-7-14/h13-15H,3-12H2,1-2H3/t15-/m1/s1
InChIKeyUXZRSRQFWDFUEC-OAHLLOKOSA-N
XLogP3.36
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine?
The IUPAC name of (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine (CID 95486281) is (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine.
What is the SMILES notation for (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine?
The canonical SMILES for (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine is CC(C)c1nnc(CN2CCO[C@H](CC3CCCCC3)C2)o1.
What is the InChIKey of (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine?
The InChIKey is UXZRSRQFWDFUEC-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H29N3O2/c1-13(2)17-19-18-16(22-17)12-20-8-9-21-15(11-20)10-14-6-4-3-5-7-14/h13-15H,3-12H2,1-2H3/t15-/m1/s1.
What are the key properties of (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine?
(2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine has a molecular weight of 307.44 g/mol, XLogP of 3.36, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(cyclohexylmethyl)-4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine is sourced from PubChem (CID 95486281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).