4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide

C14H15BrN4O2 — CID 155673040

IUPAC4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide
SMILESNC(=O)c1cnc2c(Br)cc(N3CCOCC3)cc2c1N
InChIInChI=1S/C14H15BrN4O2/c15-11-6-8(19-1-3-21-4-2-19)5-9-12(16)10(14(17)20)7-18-13(9)11/h5-7H,1-4H2,(H2,16,18)(H2,17,20)
InChIKeyWTLGCBSOFZETPC-UHFFFAOYSA-N
MW351.20 g/mol
LogP1.51
Rot. Bonds2

About 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide

4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide (PubChem CID 155673040) has the molecular formula C14H15BrN4O2 and a molecular weight of 351.20 g/mol. Its IUPAC name is 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide.

Molecular Properties

Compound Name4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide
PubChem CID155673040
Molecular FormulaC14H15BrN4O2
Molecular Weight351.20 g/mol
Exact Mass350.04
IUPAC Name4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide
SMILESNC(=O)c1cnc2c(Br)cc(N3CCOCC3)cc2c1N
InChIInChI=1S/C14H15BrN4O2/c15-11-6-8(19-1-3-21-4-2-19)5-9-12(16)10(14(17)20)7-18-13(9)11/h5-7H,1-4H2,(H2,16,18)(H2,17,20)
InChIKeyWTLGCBSOFZETPC-UHFFFAOYSA-N
XLogP1.51
TPSA94.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.20
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-morpholin-4-yl-1H-benzimidazole-4-carboxamide
CID 123491353
4-morpholin-4-ylpyridine-2,5-dicarboxamide
CID 155353746
3-(4-morpholin-4-ylphenyl)-1,2-oxazole-5-carboxamide
CID 68864303
ethyl 3-bromo-7-morpholin-4-ylthieno[3,2-b]pyridine-6-carboxylate
CID 163397208
2-N,2-N-dimethyl-4-morpholin-4-ylpyridine-2,5-dicarboxamide
CID 175198510
2-bromo-4-(1,4-oxazepan-4-yl)benzoic acid
CID 107282034
1-isoquinolin-3-yl-2-methyl-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134364221
1-(7-chloroquinolin-3-yl)-2-methyl-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134364268
2-methyl-1-(3-methylquinolin-4-yl)-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134361790
1-(3,8-dichloroquinolin-4-yl)-2-ethyl-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134361785
6-(2,6-difluorophenyl)-4-[(5-morpholin-4-yl-2-pyridinyl)amino]pyridine-3-carboxamide
CID 174998817
3-amino-5-morpholin-4-ylbenzoic acid
CID 67513749

Frequently Asked Questions

What is the IUPAC name of 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide?
The IUPAC name of 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide (CID 155673040) is 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide.
What is the SMILES notation for 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide?
The canonical SMILES for 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide is NC(=O)c1cnc2c(Br)cc(N3CCOCC3)cc2c1N.
What is the InChIKey of 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide?
The InChIKey is WTLGCBSOFZETPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN4O2/c15-11-6-8(19-1-3-21-4-2-19)5-9-12(16)10(14(17)20)7-18-13(9)11/h5-7H,1-4H2,(H2,16,18)(H2,17,20).
What are the key properties of 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide?
4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide has a molecular weight of 351.20 g/mol, XLogP of 1.51, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-8-bromo-6-morpholin-4-ylquinoline-3-carboxamide is sourced from PubChem (CID 155673040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).