4-(6-chloro-2-pyridinyl)morpholine

C9H11ClN2O — CID 15534824

IUPAC4-(6-chloro-2-pyridinyl)morpholine
SMILESClc1cccc(N2CCOCC2)n1
InChIInChI=1S/C9H11ClN2O/c10-8-2-1-3-9(11-8)12-4-6-13-7-5-12/h1-3H,4-7H2
InChIKeyRCTMSAAXJZTYHV-UHFFFAOYSA-N
MW198.65 g/mol
LogP1.57
Rot. Bonds1

About 4-(6-chloro-2-pyridinyl)morpholine

4-(6-chloro-2-pyridinyl)morpholine (PubChem CID 15534824) has the molecular formula C9H11ClN2O and a molecular weight of 198.65 g/mol. Its IUPAC name is 4-(6-chloro-2-pyridinyl)morpholine.

Molecular Properties

Compound Name4-(6-chloro-2-pyridinyl)morpholine
PubChem CID15534824
Molecular FormulaC9H11ClN2O
Molecular Weight198.65 g/mol
Exact Mass198.06
IUPAC Name4-(6-chloro-2-pyridinyl)morpholine
SMILESClc1cccc(N2CCOCC2)n1
InChIInChI=1S/C9H11ClN2O/c10-8-2-1-3-9(11-8)12-4-6-13-7-5-12/h1-3H,4-7H2
InChIKeyRCTMSAAXJZTYHV-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

CID 131746
CID 131746
CID 131747
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CID 3024499
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CID 10727230
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CID 3024498
CID 3024498
CID 10964853
CID 10964853
CID 2815854
CID 2815854
CID 2795362
CID 2795362
CID 7164599
CID 7164599
CID 17750161
CID 17750161
CID 18525737
CID 18525737
CID 18771860
CID 18771860

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-2-pyridinyl)morpholine?
The IUPAC name of 4-(6-chloro-2-pyridinyl)morpholine (CID 15534824) is 4-(6-chloro-2-pyridinyl)morpholine.
What is the SMILES notation for 4-(6-chloro-2-pyridinyl)morpholine?
The canonical SMILES for 4-(6-chloro-2-pyridinyl)morpholine is Clc1cccc(N2CCOCC2)n1.
What is the InChIKey of 4-(6-chloro-2-pyridinyl)morpholine?
The InChIKey is RCTMSAAXJZTYHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O/c10-8-2-1-3-9(11-8)12-4-6-13-7-5-12/h1-3H,4-7H2.
What are the key properties of 4-(6-chloro-2-pyridinyl)morpholine?
4-(6-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-(6-chloro-2-pyridinyl)morpholine is sourced from PubChem (CID 15534824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).