6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine

C16H24N6O — CID 66507578

IUPAC6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine
SMILESCC1CCCC(C)N1Cc1nc(N)nc(NCc2ccco2)n1
InChIInChI=1S/C16H24N6O/c1-11-5-3-6-12(2)22(11)10-14-19-15(17)21-16(20-14)18-9-13-7-4-8-23-13/h4,7-8,11-12H,3,5-6,9-10H2,1-2H3,(H3,17,18,19,20,21)
InChIKeyAWQBJWPEPZNZTJ-UHFFFAOYSA-N
MW316.41 g/mol
LogP2.42
Rot. Bonds5

About 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine

6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 66507578) has the molecular formula C16H24N6O and a molecular weight of 316.41 g/mol. Its IUPAC name is 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine
PubChem CID66507578
Molecular FormulaC16H24N6O
Molecular Weight316.41 g/mol
Exact Mass316.20
IUPAC Name6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine
SMILESCC1CCCC(C)N1Cc1nc(N)nc(NCc2ccco2)n1
InChIInChI=1S/C16H24N6O/c1-11-5-3-6-12(2)22(11)10-14-19-15(17)21-16(20-14)18-9-13-7-4-8-23-13/h4,7-8,11-12H,3,5-6,9-10H2,1-2H3,(H3,17,18,19,20,21)
InChIKeyAWQBJWPEPZNZTJ-UHFFFAOYSA-N
XLogP2.42
TPSA93.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

2-N-(furan-2-ylmethyl)-6-(piperidin-1-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 66507544
4-N-(furan-2-ylmethyl)-6-(2-methylpiperidin-1-yl)pyrimidine-4,5-diamine
CID 19140123
2-[(2,6-dimethylpiperidin-1-yl)methyl]pyridin-3-amine
CID 104739730
6-(2,6-dimethylmorpholin-4-yl)-2-N-(furan-2-ylmethyl)-5-nitropyrimidine-2,4-diamine
CID 4044963
2-N,2-N-diethyl-4-N-[2-(furan-2-yl)ethyl]-1,3,5-triazine-2,4,6-triamine
CID 80804048
[6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]hydrazine
CID 79243846
N-(furan-2-ylmethyl)-4-(4-methylpiperidin-1-yl)aniline
CID 83949682
4-(2-ethylpiperidin-1-yl)-N-(furan-2-ylmethyl)-6-methylpyrimidin-2-amine
CID 112915344
6-chloro-4-N-ethyl-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 1146272
2-N,2-N,6-N-triethyl-4-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
CID 80750440
N-(furan-2-ylmethyl)-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine
CID 80932085
N-(furan-2-ylmethyl)pyrimidin-2-amine
CID 28514232

Frequently Asked Questions

What is the IUPAC name of 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine (CID 66507578) is 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine is CC1CCCC(C)N1Cc1nc(N)nc(NCc2ccco2)n1.
What is the InChIKey of 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is AWQBJWPEPZNZTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N6O/c1-11-5-3-6-12(2)22(11)10-14-19-15(17)21-16(20-14)18-9-13-7-4-8-23-13/h4,7-8,11-12H,3,5-6,9-10H2,1-2H3,(H3,17,18,19,20,21).
What are the key properties of 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine?
6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 316.41 g/mol, XLogP of 2.42, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-N-(furan-2-ylmethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 66507578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).