6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine

C11H14N4O — CID 79828230

IUPAC6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine
SMILESCN(Cc1ccco1)c1ccc(N)c(N)n1
InChIInChI=1S/C11H14N4O/c1-15(7-8-3-2-6-16-8)10-5-4-9(12)11(13)14-10/h2-6H,7,12H2,1H3,(H2,13,14)
InChIKeyBRUHECQICUXSAJ-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.48
Rot. Bonds3

About 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine

6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine (PubChem CID 79828230) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine.

Molecular Properties

Compound Name6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine
PubChem CID79828230
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine
SMILESCN(Cc1ccco1)c1ccc(N)c(N)n1
InChIInChI=1S/C11H14N4O/c1-15(7-8-3-2-6-16-8)10-5-4-9(12)11(13)14-10/h2-6H,7,12H2,1H3,(H2,13,14)
InChIKeyBRUHECQICUXSAJ-UHFFFAOYSA-N
XLogP1.48
TPSA81.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-cyclopropyl-6-N-(furan-2-ylmethyl)pyridine-2,3,6-triamine
CID 79827765
6-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyridazin-3-amine
CID 62301068
2-N-(2-aminoethyl)-4-N-(furan-2-ylmethyl)-4-N-methylpyrimidine-2,4-diamine
CID 91018803
[6-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol
CID 61256036
4-N-(furan-2-ylmethyl)-4-N,2-dimethyl-1H-imidazole-4,5-diamine
CID 82237096
4-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylpyrimidin-2-amine
CID 107541586
6-[(cyclopropylamino)methyl]-N-(furan-2-ylmethyl)-N-methylpyridin-2-amine
CID 62280784
1-(furan-2-yl)-N-(furan-2-ylmethyl)-N-methylmethanamine;hydrochloride
CID 3028206
6-chloro-2-N-(furan-2-ylmethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 55125089
3-(aminomethyl)-N-(furan-2-ylmethyl)-N-methylisoquinolin-1-amine
CID 62299114
3-ethyl-5-N-(furan-2-ylmethyl)-5-N,1-dimethylpyrazole-4,5-diamine
CID 66014982
3-(aminomethyl)-N-(furan-2-ylmethyl)-N,4,6-trimethylpyridin-2-amine
CID 61176681

Frequently Asked Questions

What is the IUPAC name of 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine?
The IUPAC name of 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine (CID 79828230) is 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine.
What is the SMILES notation for 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine?
The canonical SMILES for 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine is CN(Cc1ccco1)c1ccc(N)c(N)n1.
What is the InChIKey of 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine?
The InChIKey is BRUHECQICUXSAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15(7-8-3-2-6-16-8)10-5-4-9(12)11(13)14-10/h2-6H,7,12H2,1H3,(H2,13,14).
What are the key properties of 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine?
6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine has a molecular weight of 218.26 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,3,6-triamine is sourced from PubChem (CID 79828230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).