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

C14H26N6O — CID 106138050

IUPAC3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
SMILESCCCNc1nc(NCC2CCC(O)C2)nc(N(C)C)n1
InChIInChI=1S/C14H26N6O/c1-4-7-15-12-17-13(19-14(18-12)20(2)3)16-9-10-5-6-11(21)8-10/h10-11,21H,4-9H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyBNKZPLQXEBMAEO-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.33
Rot. Bonds7

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

3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol (PubChem CID 106138050) has the molecular formula C14H26N6O and a molecular weight of 294.40 g/mol. Its IUPAC name is 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
PubChem CID106138050
Molecular FormulaC14H26N6O
Molecular Weight294.40 g/mol
Exact Mass294.22
IUPAC Name3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
SMILESCCCNc1nc(NCC2CCC(O)C2)nc(N(C)C)n1
InChIInChI=1S/C14H26N6O/c1-4-7-15-12-17-13(19-14(18-12)20(2)3)16-9-10-5-6-11(21)8-10/h10-11,21H,4-9H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyBNKZPLQXEBMAEO-UHFFFAOYSA-N
XLogP1.33
TPSA86.20 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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

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Related Compounds

2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 107415912
3-[[[4-chloro-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclobutan-1-ol
CID 80855943
3-[[[4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclobutan-1-ol
CID 66006832
2-[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]ethanol
CID 80765149
5-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]pyrrolidin-2-one
CID 80823542
3-[[[5-bromo-2-(propylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 106137969
4-N-cyclohexyl-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80766155
[2-[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
CID 106368088
2-N,2-N-dimethyl-6-N-propyl-4-N-(thiolan-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 103065188
4-N-(2,2-dimethylpropyl)-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80797913
3-[[(4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-yl)amino]methyl]cyclopentan-1-ol
CID 114148716
2-N,2-N-dimethyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine
CID 90159200

Frequently Asked Questions

What is the IUPAC name of 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol (CID 106138050) is 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol is CCCNc1nc(NCC2CCC(O)C2)nc(N(C)C)n1.
What is the InChIKey of 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol?
The InChIKey is BNKZPLQXEBMAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6O/c1-4-7-15-12-17-13(19-14(18-12)20(2)3)16-9-10-5-6-11(21)8-10/h10-11,21H,4-9H2,1-3H3,(H2,15,16,17,18,19).
What are the key properties of 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol?
3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol has a molecular weight of 294.40 g/mol, XLogP of 1.33, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 106138050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).