2-N,3-N,4-N-trimethylfuran-2,3,4-triamine

C7H13N3O — CID 174474232

IUPAC2-N,3-N,4-N-trimethylfuran-2,3,4-triamine
SMILESCNc1coc(NC)c1NC
InChIInChI=1S/C7H13N3O/c1-8-5-4-11-7(10-3)6(5)9-2/h4,8-10H,1-3H3
InChIKeyOQDUDBRBTCVLCH-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.40
Rot. Bonds3

About 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine

2-N,3-N,4-N-trimethylfuran-2,3,4-triamine (PubChem CID 174474232) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine.

Molecular Properties

Compound Name2-N,3-N,4-N-trimethylfuran-2,3,4-triamine
PubChem CID174474232
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name2-N,3-N,4-N-trimethylfuran-2,3,4-triamine
SMILESCNc1coc(NC)c1NC
InChIInChI=1S/C7H13N3O/c1-8-5-4-11-7(10-3)6(5)9-2/h4,8-10H,1-3H3
InChIKeyOQDUDBRBTCVLCH-UHFFFAOYSA-N
XLogP1.40
TPSA49.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-Amino-1-methyl-2-(trifluoromethyl)-2,4-dihydrofuro[3,4-b]pyrazin-3-one
CID 82375669
2-N-methylfuran-2,3-diamine
CID 20200448
3-N,4-N-dimethylfuran-3,4-diamine
CID 21099945
Furan-2,3,4-triamine
CID 46835340
2,3-dihydro-1H-furo[2,3-d]imidazole
CID 58996134
1,2,3,4-Tetrahydrofuro[2,3-b]pyrazine
CID 67258053
2-N,2-N-dimethylfuran-2,3-diamine
CID 123815457
4-[(Z)-2-aminoethenyl]-2-N-methylfuran-2,3-diamine
CID 134334627
3-N,3-N-dimethylfuran-3,4-diamine
CID 140081880
4-Amino-2-(propylamino)furan-3-carbonitrile
CID 141120274
1-methoxy-2H-furo[2,3-b]pyrazin-7-amine
CID 142626416
2-N,3-N,4-N-tributyl-2-N,3-N,4-N-trimethylfuran-2,3,4-triamine
CID 142692154

Frequently Asked Questions

What is the IUPAC name of 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine?
The IUPAC name of 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine (CID 174474232) is 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine.
What is the SMILES notation for 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine?
The canonical SMILES for 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine is CNc1coc(NC)c1NC.
What is the InChIKey of 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine?
The InChIKey is OQDUDBRBTCVLCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-8-5-4-11-7(10-3)6(5)9-2/h4,8-10H,1-3H3.
What are the key properties of 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine?
2-N,3-N,4-N-trimethylfuran-2,3,4-triamine has a molecular weight of 155.20 g/mol, XLogP of 1.40, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N,4-N-trimethylfuran-2,3,4-triamine is sourced from PubChem (CID 174474232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).