4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol

C14H25N5O2 — CID 80827568

IUPAC4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol
SMILESCCC1CCC(O)(CNc2nc(NC)nc(OC)n2)CC1
InChIInChI=1S/C14H25N5O2/c1-4-10-5-7-14(20,8-6-10)9-16-12-17-11(15-2)18-13(19-12)21-3/h10,20H,4-9H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyJLPMUVYKDXGNAL-UHFFFAOYSA-N
MW295.39 g/mol
LogP1.67
Rot. Bonds6

About 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol

4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol (PubChem CID 80827568) has the molecular formula C14H25N5O2 and a molecular weight of 295.39 g/mol. Its IUPAC name is 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol
PubChem CID80827568
Molecular FormulaC14H25N5O2
Molecular Weight295.39 g/mol
Exact Mass295.20
IUPAC Name4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol
SMILESCCC1CCC(O)(CNc2nc(NC)nc(OC)n2)CC1
InChIInChI=1S/C14H25N5O2/c1-4-10-5-7-14(20,8-6-10)9-16-12-17-11(15-2)18-13(19-12)21-3/h10,20H,4-9H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyJLPMUVYKDXGNAL-UHFFFAOYSA-N
XLogP1.67
TPSA92.19 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

4-ethyl-1-[[(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 80920706
1-[[(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 80915857
1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
CID 80842810
1-[[(4,6-dichloro-1,3,5-triazin-2-yl)amino]methyl]-4-ethylcyclohexan-1-ol
CID 65122923
1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cycloheptan-1-ol
CID 80829131
1-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]-4-ethylcyclohexan-1-ol
CID 105362695
4-ethyl-1-[[[5-fluoro-2-(methylamino)pyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 80843418
4-ethyl-1-[[(5-methylpyrimidin-2-yl)amino]methyl]cyclohexan-1-ol
CID 65120061
4-[[[4-(methylamino)-6-propan-2-yloxy-1,3,5-triazin-2-yl]amino]methyl]oxan-4-ol
CID 81134636
4-ethyl-1-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 66327648
4-ethyl-1-[[[2-(ethylamino)-6-methylpyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 80827870
4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80867582

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol (CID 80827568) is 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol is CCC1CCC(O)(CNc2nc(NC)nc(OC)n2)CC1.
What is the InChIKey of 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol?
The InChIKey is JLPMUVYKDXGNAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O2/c1-4-10-5-7-14(20,8-6-10)9-16-12-17-11(15-2)18-13(19-12)21-3/h10,20H,4-9H2,1-3H3,(H2,15,16,17,18,19).
What are the key properties of 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol?
4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol has a molecular weight of 295.39 g/mol, XLogP of 1.67, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 80827568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).