N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide

C15H20BrN3O2 — CID 153294812

IUPACN-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide
SMILESCC(=O)NC1CC2(C1)CC(Nc1cc(=O)n(C)cc1Br)C2
InChIInChI=1S/C15H20BrN3O2/c1-9(20)17-10-4-15(5-10)6-11(7-15)18-13-3-14(21)19(2)8-12(13)16/h3,8,10-11,18H,4-7H2,1-2H3,(H,17,20)
InChIKeyVVQCYVNGHDWPDD-UHFFFAOYSA-N
MW354.25 g/mol
LogP2.01
Rot. Bonds3

About N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide

N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide (PubChem CID 153294812) has the molecular formula C15H20BrN3O2 and a molecular weight of 354.25 g/mol. Its IUPAC name is N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide
PubChem CID153294812
Molecular FormulaC15H20BrN3O2
Molecular Weight354.25 g/mol
Exact Mass353.07
IUPAC NameN-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide
SMILESCC(=O)NC1CC2(C1)CC(Nc1cc(=O)n(C)cc1Br)C2
InChIInChI=1S/C15H20BrN3O2/c1-9(20)17-10-4-15(5-10)6-11(7-15)18-13-3-14(21)19(2)8-12(13)16/h3,8,10-11,18H,4-7H2,1-2H3,(H,17,20)
InChIKeyVVQCYVNGHDWPDD-UHFFFAOYSA-N
XLogP2.01
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.25
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)oxy]cyclohexyl]-2-hydroxyacetamide
CID 153294959
methyl 2-(5-bromo-1-methyl-2-oxo-4-pyridinyl)acetate
CID 131580081
4-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)oxy]cyclohexane-1-carboxamide
CID 150502899
N-[4-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)oxy]cyclohexyl]acetohydrazide;hydrochloride
CID 153294813
5-bromo-6-[(4-methylcycloheptyl)amino]-1,3-dihydrobenzimidazol-2-one
CID 65080019
N-(3,3,6,6-tetramethylcycloheptyl)acetamide
CID 142825671
N-[4-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)oxy]cyclohexyl]-N,1-dimethylcyclopropane-1-carboxamide
CID 153294882
4-bromo-5-fluoro-1-methylpyridin-2-one
CID 59635671
4-bromo-5-chloro-1-methylpyridin-2-one
CID 105479911
N-[2-[4-[6-amino-5-(trifluoromethoxy)-3-pyridinyl]-2-cyclopropylimidazol-1-yl]spiro[3.3]heptan-6-yl]acetamide
CID 167500058
1-[1-(difluoromethyl)cyclopropyl]-4-[(1-methylpiperidin-4-yl)amino]-6-oxopyridine-3-carboxylic acid
CID 169126932
5-bromo-6-[(4-propylcyclohexyl)amino]-1,3-dihydrobenzimidazol-2-one
CID 43741303

Frequently Asked Questions

What is the IUPAC name of N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide?
The IUPAC name of N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide (CID 153294812) is N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide.
What is the SMILES notation for N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide?
The canonical SMILES for N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide is CC(=O)NC1CC2(C1)CC(Nc1cc(=O)n(C)cc1Br)C2.
What is the InChIKey of N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide?
The InChIKey is VVQCYVNGHDWPDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrN3O2/c1-9(20)17-10-4-15(5-10)6-11(7-15)18-13-3-14(21)19(2)8-12(13)16/h3,8,10-11,18H,4-7H2,1-2H3,(H,17,20).
What are the key properties of N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide?
N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide has a molecular weight of 354.25 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(5-bromo-1-methyl-2-oxo-4-pyridinyl)amino]spiro[3.3]heptan-2-yl]acetamide is sourced from PubChem (CID 153294812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).