(2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine

C13H17ClN2O — CID 164639388

IUPAC(2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine
SMILESCc1nc(N2CCO[C@H](C3CC3)C2)ccc1Cl
InChIInChI=1S/C13H17ClN2O/c1-9-11(14)4-5-13(15-9)16-6-7-17-12(8-16)10-2-3-10/h4-5,10,12H,2-3,6-8H2,1H3/t12-/m0/s1
InChIKeyXCKQZQBMIKWVMZ-LBPRGKRZSA-N
MW252.74 g/mol
LogP2.66
Rot. Bonds2

About (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine

(2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine (PubChem CID 164639388) has the molecular formula C13H17ClN2O and a molecular weight of 252.74 g/mol. Its IUPAC name is (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine.

Molecular Properties

Compound Name(2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine
PubChem CID164639388
Molecular FormulaC13H17ClN2O
Molecular Weight252.74 g/mol
Exact Mass252.10
IUPAC Name(2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine
SMILESCc1nc(N2CCO[C@H](C3CC3)C2)ccc1Cl
InChIInChI=1S/C13H17ClN2O/c1-9-11(14)4-5-13(15-9)16-6-7-17-12(8-16)10-2-3-10/h4-5,10,12H,2-3,6-8H2,1H3/t12-/m0/s1
InChIKeyXCKQZQBMIKWVMZ-LBPRGKRZSA-N
XLogP2.66
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.74
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine?
The IUPAC name of (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine (CID 164639388) is (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine.
What is the SMILES notation for (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine?
The canonical SMILES for (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine is Cc1nc(N2CCO[C@H](C3CC3)C2)ccc1Cl.
What is the InChIKey of (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine?
The InChIKey is XCKQZQBMIKWVMZ-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H17ClN2O/c1-9-11(14)4-5-13(15-9)16-6-7-17-12(8-16)10-2-3-10/h4-5,10,12H,2-3,6-8H2,1H3/t12-/m0/s1.
What are the key properties of (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine?
(2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine has a molecular weight of 252.74 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(5-chloro-6-methyl-2-pyridinyl)-2-cyclopropylmorpholine is sourced from PubChem (CID 164639388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).