N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide

C10H16N4O — CID 58465596

IUPACN,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide
SMILESCNC(=O)c1cn2c(n1)CN(C)CCC2
InChIInChI=1S/C10H16N4O/c1-11-10(15)8-6-14-5-3-4-13(2)7-9(14)12-8/h6H,3-5,7H2,1-2H3,(H,11,15)
InChIKeyYKRLJBWFKMOALO-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.08
Rot. Bonds1

About N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide

N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide (PubChem CID 58465596) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide.

Molecular Properties

Compound NameN,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide
PubChem CID58465596
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC NameN,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide
SMILESCNC(=O)c1cn2c(n1)CN(C)CCC2
InChIInChI=1S/C10H16N4O/c1-11-10(15)8-6-14-5-3-4-13(2)7-9(14)12-8/h6H,3-5,7H2,1-2H3,(H,11,15)
InChIKeyYKRLJBWFKMOALO-UHFFFAOYSA-N
XLogP0.08
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
CID 145225752
lithium;6,7-dihydro-5H-pyrrolo[1,2-a]imidazole-2-carboxylic acid;hydride
CID 174674138
N-butan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
CID 71838087
7-[1-(2-amino-2-oxoethyl)piperidine-3-carbonyl]-N-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide
CID 155912376
7-[(2-methylpropan-2-yl)oxycarbonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid;hydrate
CID 154701035
N-(2,5-dimethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
CID 71838084
2-N,6-N-dimethyl-4-piperidin-1-ylpyridine-2,6-dicarboxamide
CID 13235645
7-(4-tert-butylbenzoyl)-N-hydroxy-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
CID 58465723
N-[(4-methylsulfanylphenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
CID 53167923
N-[(4-propan-2-ylphenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
CID 71838020
methyl 7-nitro-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylate
CID 13247053
N,2-dimethyl-1,3,4,5-tetrahydro-2-benzazepine-8-carboxamide
CID 58147184

Frequently Asked Questions

What is the IUPAC name of N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide?
The IUPAC name of N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide (CID 58465596) is N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide.
What is the SMILES notation for N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide?
The canonical SMILES for N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide is CNC(=O)c1cn2c(n1)CN(C)CCC2.
What is the InChIKey of N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide?
The InChIKey is YKRLJBWFKMOALO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-11-10(15)8-6-14-5-3-4-13(2)7-9(14)12-8/h6H,3-5,7H2,1-2H3,(H,11,15).
What are the key properties of N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide?
N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 0.08, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,8-dimethyl-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine-2-carboxamide is sourced from PubChem (CID 58465596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).