N1-(2-Furanylmethyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine
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Basic information
- CAS
531-06-6- Standard SMILES
CN(C)CCN(Cc1ccco1)c1ccccn1- InChIKey
LUQHAHRMUPOTQK-UHFFFAOYSA-N- Molecular formula
- C14H19N3O
- Average molar mass
- 245.32 g/mol
- Monoisotopic mass
- 245.15281224
Overview
not carcinogenic; structure given in first source
Names & identifiers
- Preferred name
- N1-(2-Furanylmethyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamine
- IUPAC
- N'-(furan-2-ylmethyl)-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine
- English name
- methafurylene
- Molecular formula
- C14H19N3O
- Molecular weight
- 245.32
Names & synonyms
Methafurylene531-06-6HU5BZT118TNSC-35569F-151 FREE BASEDTXSID0020816RefChem:927365DTXCID80816N1-(2-Furanylmethyl)-N2,N2-dimethyl-N1-2-pyridinyl-1,2-ethanediamineForalamineMethafurilen2-((2-Dimethylaminoethyl)furfurylamino)pyridine
Show more names
F-151ForalaminMethafurilene2-dimethylaminoethyl-(2-furylmethyl)-(2-pyridyl)amineN-(2-Furanylmethyl)-N',N'-dimethyl-N-(2-pyridinyl)-1,2-ethanediamineN-(furan-2-ylmethyl)-N',N'-dimethyl-N-pyridin-2-ylethane-1,2-diamineN-(furan-2-ylmethyl)-N',N'-dimethyl-N-pyridin-2-yl-ethane-1,2-diamine1,2-Ethanediamine, N1-(2-furanylmethyl)-N2,N2-dimethyl-N1-2-pyridinyl-
Pyridine, 2-((2-(dimethylamino)ethyl)furfurylamino)-2-[(2-Dimethylaminoethyl)furfurylamino]pyridineNSC 35569Pyridine, 2-[[2-(dimethylamino)ethyl]furfurylamino]-UNII-HU5BZT118TN'-(furan-2-ylmethyl)-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamineMETHAFURYLENE [MI]SCHEMBL143903
Database identifiers
- CAS
531-06-6- PubChem CID
- 21563
- DTXSID
DTXSID0020816- ChEMBL
CHEMBL1740417- UNII
- HU5BZT118T
- Nikkaji
- J6.977I
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 32.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Boiling point
- 0.2 · bp0.2 117.5-118°
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
- pka
- 8.91 · 8.91±0.28(Predicted)
- FDA UNII
- 5 BZT118T · HU5BZT118T
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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