(2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone

C19H16ClN3O3 — CID 89478019

IUPAC(2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone
SMILESO=C(c1ccc2ncc(N3CCOCC3)nc2c1)c1cccc(O)c1Cl
InChIInChI=1S/C19H16ClN3O3/c20-18-13(2-1-3-16(18)24)19(25)12-4-5-14-15(10-12)22-17(11-21-14)23-6-8-26-9-7-23/h1-5,10-11,24H,6-9H2
InChIKeyQHURPOOOVNRKAV-UHFFFAOYSA-N
MW369.81 g/mol
LogP3.06
Rot. Bonds3

About (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone

(2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone (PubChem CID 89478019) has the molecular formula C19H16ClN3O3 and a molecular weight of 369.81 g/mol. Its IUPAC name is (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone.

Molecular Properties

Compound Name(2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone
PubChem CID89478019
Molecular FormulaC19H16ClN3O3
Molecular Weight369.81 g/mol
Exact Mass369.09
IUPAC Name(2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone
SMILESO=C(c1ccc2ncc(N3CCOCC3)nc2c1)c1cccc(O)c1Cl
InChIInChI=1S/C19H16ClN3O3/c20-18-13(2-1-3-16(18)24)19(25)12-4-5-14-15(10-12)22-17(11-21-14)23-6-8-26-9-7-23/h1-5,10-11,24H,6-9H2
InChIKeyQHURPOOOVNRKAV-UHFFFAOYSA-N
XLogP3.06
TPSA75.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.81
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2-fluoro-5-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone
CID 89478345
bis(2-morpholin-4-ylquinoxalin-6-yl)methanone
CID 151491691
1-(4-chloro-3-fluorophenyl)-3-[2-fluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]urea
CID 89443365
4-chloro-3-fluoro-N-[3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]benzamide
CID 89445010
3-chloro-N-[3,4-difluoro-5-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-4-fluorobenzamide
CID 89445214
1-[3-chloro-4-(trifluoromethyl)phenyl]-3-[2-fluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]urea
CID 89443424
4-chloro-3-fluoro-N-[4-fluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]benzamide
CID 89443057
1-[3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 71532895
4-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
CID 67036137
1-[3,4-difluoro-5-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 71533640
N-[3,4-difluoro-5-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]propane-1-sulfonamide
CID 71268676
1-[4-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 90134872

Frequently Asked Questions

What is the IUPAC name of (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone?
The IUPAC name of (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone (CID 89478019) is (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone.
What is the SMILES notation for (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone?
The canonical SMILES for (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone is O=C(c1ccc2ncc(N3CCOCC3)nc2c1)c1cccc(O)c1Cl.
What is the InChIKey of (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone?
The InChIKey is QHURPOOOVNRKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O3/c20-18-13(2-1-3-16(18)24)19(25)12-4-5-14-15(10-12)22-17(11-21-14)23-6-8-26-9-7-23/h1-5,10-11,24H,6-9H2.
What are the key properties of (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone?
(2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone has a molecular weight of 369.81 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone is sourced from PubChem (CID 89478019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).