4-(5-propan-2-yl-3-pyridinyl)morpholine

C12H18N2O — CID 58563222

IUPAC4-(5-propan-2-yl-3-pyridinyl)morpholine
SMILESCC(C)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C12H18N2O/c1-10(2)11-7-12(9-13-8-11)14-3-5-15-6-4-14/h7-10H,3-6H2,1-2H3
InChIKeyCANVDLDTBUGBNV-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.04
Rot. Bonds2

About 4-(5-propan-2-yl-3-pyridinyl)morpholine

4-(5-propan-2-yl-3-pyridinyl)morpholine (PubChem CID 58563222) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 4-(5-propan-2-yl-3-pyridinyl)morpholine.

Molecular Properties

Compound Name4-(5-propan-2-yl-3-pyridinyl)morpholine
PubChem CID58563222
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name4-(5-propan-2-yl-3-pyridinyl)morpholine
SMILESCC(C)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C12H18N2O/c1-10(2)11-7-12(9-13-8-11)14-3-5-15-6-4-14/h7-10H,3-6H2,1-2H3
InChIKeyCANVDLDTBUGBNV-UHFFFAOYSA-N
XLogP2.04
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(5-propan-2-yl-3-pyridinyl)morpholine?
The IUPAC name of 4-(5-propan-2-yl-3-pyridinyl)morpholine (CID 58563222) is 4-(5-propan-2-yl-3-pyridinyl)morpholine.
What is the SMILES notation for 4-(5-propan-2-yl-3-pyridinyl)morpholine?
The canonical SMILES for 4-(5-propan-2-yl-3-pyridinyl)morpholine is CC(C)c1cncc(N2CCOCC2)c1.
What is the InChIKey of 4-(5-propan-2-yl-3-pyridinyl)morpholine?
The InChIKey is CANVDLDTBUGBNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-10(2)11-7-12(9-13-8-11)14-3-5-15-6-4-14/h7-10H,3-6H2,1-2H3.
What are the key properties of 4-(5-propan-2-yl-3-pyridinyl)morpholine?
4-(5-propan-2-yl-3-pyridinyl)morpholine has a molecular weight of 206.29 g/mol, XLogP of 2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-propan-2-yl-3-pyridinyl)morpholine is sourced from PubChem (CID 58563222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).