1,3-Diazepin-2-one, hexahydro-1,3-dimethyl-
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Basic information
- CAS
16597-38-9- Standard SMILES
CN1CCCCN(C)C1=O- InChIKey
BSVHATKBZZYYIC-UHFFFAOYSA-N- Molecular formula
- C7H14N2O
- Average molar mass
- 142.2 g/mol
- Monoisotopic mass
- 142.11061307
Names & identifiers
- Preferred name
- 1,3-Diazepin-2-one, hexahydro-1,3-dimethyl-
- IUPAC
- 1,3-dimethyl-1,3-diazepan-2-one
- English name
- 1,3-Dimethyl-4,5,6,7-tetrahydro-1H-1,3-diazepine-2(3H)-one
- Molecular formula
- C7H14N2O
- Molecular weight
- 142.2
Names & synonyms
16597-38-9N,N'-DimethyltetramethyleneureaBRN 06366051,3-DIAZEPIN-2-ONE, HEXAHYDRO-1,3-DIMETHYL-Hexahydro-1,3-dimethyl-1,3-diazepin-2-oneDTXSID40168057RefChem:218347DTXCID00905482H-1,3-Diazepin-2-one, hexahydro-1,3-dimethyl-(8CI,9CI)1,3-dimethyl-1,3-diazepan-2-one1,3-Dimethyl-4,5,6,7-tetrahydro-1H-1,3-diazepine-2(3H)-one2H-1,3-Diazepin-2-one, hexahydro-1,3-dimethyl-
Show more names
Hexahydro-1,3-dimethyl-1H-1,3-diazepin-2-one
CHEMBL268227SCHEMBL8272670
Database identifiers
- CAS
16597-38-9- PubChem CID
- 27949
- DTXSID
DTXSID40168057- ChEMBL
CHEMBL268227- Nikkaji
- J40.866B
Properties
Computed structural propertiesFilling in
- XLogP
- 0.2
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 122
Related reactions
0 records
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Compound notes
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