4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine

C11H15N7O — CID 80781643

IUPAC4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine
SMILESCC1COCCN1c1nc(N)nc(-n2ccnc2)n1
InChIInChI=1S/C11H15N7O/c1-8-6-19-5-4-18(8)11-15-9(12)14-10(16-11)17-3-2-13-7-17/h2-3,7-8H,4-6H2,1H3,(H2,12,14,15,16)
InChIKeyASNPZZNESMVYLI-UHFFFAOYSA-N
MW261.29 g/mol
LogP-0.14
Rot. Bonds2

About 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine

4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine (PubChem CID 80781643) has the molecular formula C11H15N7O and a molecular weight of 261.29 g/mol. Its IUPAC name is 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine
PubChem CID80781643
Molecular FormulaC11H15N7O
Molecular Weight261.29 g/mol
Exact Mass261.13
IUPAC Name4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine
SMILESCC1COCCN1c1nc(N)nc(-n2ccnc2)n1
InChIInChI=1S/C11H15N7O/c1-8-6-19-5-4-18(8)11-15-9(12)14-10(16-11)17-3-2-13-7-17/h2-3,7-8H,4-6H2,1H3,(H2,12,14,15,16)
InChIKeyASNPZZNESMVYLI-UHFFFAOYSA-N
XLogP-0.14
TPSA94.98 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.29
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

4-(2,4-dimethylpiperidin-1-yl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80826985
4-(3-methylmorpholin-4-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80782138
4-(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)-3-ethylmorpholine
CID 62864577
(3R)-3-methyl-4-[4-methyl-6-[(3S)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
CID 155440037
(3R)-3-methyl-4-[4-methyl-6-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]morpholine
CID 155439964
4-(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)morpholine-3-carboxamide
CID 83098938
(3S)-4-(4-chloro-6-methyl-5-nitropyrimidin-2-yl)-3-methylmorpholine;(3S)-4-(4-imidazol-1-yl-6-methyl-5-nitropyrimidin-2-yl)-3-methylmorpholine
CID 158265648
4-(2-ethylpyrrolidin-1-yl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80798127
6-imidazol-1-yl-4-N-methyl-4-N-(oxan-3-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80817419
4-[4-chloro-6-[(3S)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]-3-methylmorpholine
CID 139520999
(3S)-4-(4-imidazol-1-yl-6-methyl-5-nitropyrimidin-2-yl)-3-methylmorpholine;methanesulfonic acid
CID 137331932
1-(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)piperidin-4-ol
CID 80764330

Frequently Asked Questions

What is the IUPAC name of 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine (CID 80781643) is 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine is CC1COCCN1c1nc(N)nc(-n2ccnc2)n1.
What is the InChIKey of 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine?
The InChIKey is ASNPZZNESMVYLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O/c1-8-6-19-5-4-18(8)11-15-9(12)14-10(16-11)17-3-2-13-7-17/h2-3,7-8H,4-6H2,1H3,(H2,12,14,15,16).
What are the key properties of 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine?
4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine has a molecular weight of 261.29 g/mol, XLogP of -0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80781643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).