1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol

C12H21N5O2 — CID 80842810

IUPAC1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
SMILESCCNc1nc(NCC2(O)CCCC2)nc(OC)n1
InChIInChI=1S/C12H21N5O2/c1-3-13-9-15-10(17-11(16-9)19-2)14-8-12(18)6-4-5-7-12/h18H,3-8H2,1-2H3,(H2,13,14,15,16,17)
InChIKeyLAKVDFTZTJTHSN-UHFFFAOYSA-N
MW267.33 g/mol
LogP1.03
Rot. Bonds6

About 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol

1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol (PubChem CID 80842810) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
PubChem CID80842810
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC Name1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
SMILESCCNc1nc(NCC2(O)CCCC2)nc(OC)n1
InChIInChI=1S/C12H21N5O2/c1-3-13-9-15-10(17-11(16-9)19-2)14-8-12(18)6-4-5-7-12/h18H,3-8H2,1-2H3,(H2,13,14,15,16,17)
InChIKeyLAKVDFTZTJTHSN-UHFFFAOYSA-N
XLogP1.03
TPSA92.19 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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

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Related Compounds

1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cycloheptan-1-ol
CID 80829131
1-[[[4-ethoxy-6-(ethylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
CID 80842897
4-ethyl-1-[[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclohexan-1-ol
CID 80827568
1-[[(4,6-dimethoxypyrimidin-2-yl)amino]methyl]cyclopentan-1-ol
CID 115355172
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-hydrazinyl-6-propoxy-1,3,5-triazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 80909114
6-methoxy-2-N-[(1-methylcyclopentyl)methyl]-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80846170
2-[1-[[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]methyl]cyclopropyl]ethanol
CID 114749654
2-N-(cyclopentylmethyl)-4-N-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 80783826
1-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]-2-methylpropan-2-ol
CID 80841768
1-[[[4-ethoxy-6-(ethylamino)-1,3,5-triazin-2-yl]-methylamino]methyl]cyclopentan-1-ol
CID 114953966

Frequently Asked Questions

What is the IUPAC name of 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol (CID 80842810) is 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol is CCNc1nc(NCC2(O)CCCC2)nc(OC)n1.
What is the InChIKey of 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol?
The InChIKey is LAKVDFTZTJTHSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-3-13-9-15-10(17-11(16-9)19-2)14-8-12(18)6-4-5-7-12/h18H,3-8H2,1-2H3,(H2,13,14,15,16,17).
What are the key properties of 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol?
1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol has a molecular weight of 267.33 g/mol, XLogP of 1.03, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 80842810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).