[4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol

C14H15ClN2O2 — CID 79839533

IUPAC[4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol
SMILESOCC1CN(c2ccnc3cc(Cl)ccc23)CCO1
InChIInChI=1S/C14H15ClN2O2/c15-10-1-2-12-13(7-10)16-4-3-14(12)17-5-6-19-11(8-17)9-18/h1-4,7,11,18H,5-6,8-9H2
InChIKeyIVUPOSVAHQOBNE-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.09
Rot. Bonds2

About [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol

[4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol (PubChem CID 79839533) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol
PubChem CID79839533
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC Name[4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol
SMILESOCC1CN(c2ccnc3cc(Cl)ccc23)CCO1
InChIInChI=1S/C14H15ClN2O2/c15-10-1-2-12-13(7-10)16-4-3-14(12)17-5-6-19-11(8-17)9-18/h1-4,7,11,18H,5-6,8-9H2
InChIKeyIVUPOSVAHQOBNE-UHFFFAOYSA-N
XLogP2.09
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol?
The IUPAC name of [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol (CID 79839533) is [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol.
What is the SMILES notation for [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol?
The canonical SMILES for [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol is OCC1CN(c2ccnc3cc(Cl)ccc23)CCO1.
What is the InChIKey of [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol?
The InChIKey is IVUPOSVAHQOBNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c15-10-1-2-12-13(7-10)16-4-3-14(12)17-5-6-19-11(8-17)9-18/h1-4,7,11,18H,5-6,8-9H2.
What are the key properties of [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol?
[4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol has a molecular weight of 278.74 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol is sourced from PubChem (CID 79839533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).