2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide

C17H16BrN3O2 — CID 160822160

IUPAC2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
SMILESNC(=O)c1cc(Br)nc2c1Cc1cc(N3CCOCC3)ccc1-2
InChIInChI=1S/C17H16BrN3O2/c18-15-9-14(17(19)22)13-8-10-7-11(21-3-5-23-6-4-21)1-2-12(10)16(13)20-15/h1-2,7,9H,3-6,8H2,(H2,19,22)
InChIKeySFRMVVMCCIHYLU-UHFFFAOYSA-N
MW374.24 g/mol
LogP2.35
Rot. Bonds2

About 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide

2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide (PubChem CID 160822160) has the molecular formula C17H16BrN3O2 and a molecular weight of 374.24 g/mol. Its IUPAC name is 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
PubChem CID160822160
Molecular FormulaC17H16BrN3O2
Molecular Weight374.24 g/mol
Exact Mass373.04
IUPAC Name2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
SMILESNC(=O)c1cc(Br)nc2c1Cc1cc(N3CCOCC3)ccc1-2
InChIInChI=1S/C17H16BrN3O2/c18-15-9-14(17(19)22)13-8-10-7-11(21-3-5-23-6-4-21)1-2-12(10)16(13)20-15/h1-2,7,9H,3-6,8H2,(H2,19,22)
InChIKeySFRMVVMCCIHYLU-UHFFFAOYSA-N
XLogP2.35
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.24
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(3-fluoro-4-hydroxyphenyl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
CID 147037417
2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
CID 149104787
2-[3-chloro-4-(morpholin-4-ylmethyl)phenyl]-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
CID 159826865
7-morpholin-4-yl-3-phenyl-9H-fluorene-1-carboxamide
CID 158093080
2-[3-chloro-4-(2-methoxyethoxy)phenyl]-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
CID 149115689
7-(morpholine-4-carbonyl)-3-(4-morpholin-4-ylphenyl)-9H-fluorene-1-carboxamide
CID 149273217
1-[2-amino-5-(1,4-oxazepan-4-yl)phenyl]ethanone
CID 113433024
2-bromo-4-(1,4-oxazepan-4-yl)benzoic acid
CID 107282034
2-hydroxyimino-5-morpholin-4-yl-3H-inden-1-one
CID 141128929
3-(2-methyl-1,3-thiazol-4-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 152964048
4-(1,4-oxazepan-4-yl)benzenecarbothioamide
CID 62974018
3-(4-morpholin-4-ylphenyl)-1,2-oxazole-5-carboxamide
CID 68864303

Frequently Asked Questions

What is the IUPAC name of 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide?
The IUPAC name of 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide (CID 160822160) is 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide.
What is the SMILES notation for 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide?
The canonical SMILES for 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide is NC(=O)c1cc(Br)nc2c1Cc1cc(N3CCOCC3)ccc1-2.
What is the InChIKey of 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide?
The InChIKey is SFRMVVMCCIHYLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16BrN3O2/c18-15-9-14(17(19)22)13-8-10-7-11(21-3-5-23-6-4-21)1-2-12(10)16(13)20-15/h1-2,7,9H,3-6,8H2,(H2,19,22).
What are the key properties of 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide?
2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide has a molecular weight of 374.24 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide is sourced from PubChem (CID 160822160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).