4-(3-chloro-2-pyridinyl)morpholine

C9H11ClN2O — CID 2815854

IUPAC4-(3-chloro-2-pyridinyl)morpholine
SMILESClc1cccnc1N1CCOCC1
InChIInChI=1S/C9H11ClN2O/c10-8-2-1-3-11-9(8)12-4-6-13-7-5-12/h1-3H,4-7H2
InChIKeyKCKQIVLNKGDTGJ-UHFFFAOYSA-N
MW198.65 g/mol
LogP1.57
Rot. Bonds1

About 4-(3-chloro-2-pyridinyl)morpholine

4-(3-chloro-2-pyridinyl)morpholine (PubChem CID 2815854) has the molecular formula C9H11ClN2O and a molecular weight of 198.65 g/mol. Its IUPAC name is 4-(3-chloro-2-pyridinyl)morpholine.

Molecular Properties

Compound Name4-(3-chloro-2-pyridinyl)morpholine
PubChem CID2815854
Molecular FormulaC9H11ClN2O
Molecular Weight198.65 g/mol
Exact Mass198.06
IUPAC Name4-(3-chloro-2-pyridinyl)morpholine
SMILESClc1cccnc1N1CCOCC1
InChIInChI=1S/C9H11ClN2O/c10-8-2-1-3-11-9(8)12-4-6-13-7-5-12/h1-3H,4-7H2
InChIKeyKCKQIVLNKGDTGJ-UHFFFAOYSA-N
XLogP1.57
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.65
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-2-pyridinyl)morpholine?
The IUPAC name of 4-(3-chloro-2-pyridinyl)morpholine (CID 2815854) is 4-(3-chloro-2-pyridinyl)morpholine.
What is the SMILES notation for 4-(3-chloro-2-pyridinyl)morpholine?
The canonical SMILES for 4-(3-chloro-2-pyridinyl)morpholine is Clc1cccnc1N1CCOCC1.
What is the InChIKey of 4-(3-chloro-2-pyridinyl)morpholine?
The InChIKey is KCKQIVLNKGDTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O/c10-8-2-1-3-11-9(8)12-4-6-13-7-5-12/h1-3H,4-7H2.
What are the key properties of 4-(3-chloro-2-pyridinyl)morpholine?
4-(3-chloro-2-pyridinyl)morpholine has a molecular weight of 198.65 g/mol, XLogP of 1.57, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-2-pyridinyl)morpholine is sourced from PubChem (CID 2815854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).