3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol

C14H26N6O — CID 80832237

IUPAC3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol
SMILESCCCNc1nc(NC2CC(O)C2)nc(N(CC)CC)n1
InChIInChI=1S/C14H26N6O/c1-4-7-15-12-17-13(16-10-8-11(21)9-10)19-14(18-12)20(5-2)6-3/h10-11,21H,4-9H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyRCZFYBCMLZMGRI-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.47
Rot. Bonds8

About 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol

3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol (PubChem CID 80832237) has the molecular formula C14H26N6O and a molecular weight of 294.40 g/mol. Its IUPAC name is 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol.

Molecular Properties

Compound Name3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol
PubChem CID80832237
Molecular FormulaC14H26N6O
Molecular Weight294.40 g/mol
Exact Mass294.22
IUPAC Name3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol
SMILESCCCNc1nc(NC2CC(O)C2)nc(N(CC)CC)n1
InChIInChI=1S/C14H26N6O/c1-4-7-15-12-17-13(16-10-8-11(21)9-10)19-14(18-12)20(5-2)6-3/h10-11,21H,4-9H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyRCZFYBCMLZMGRI-UHFFFAOYSA-N
XLogP1.47
TPSA86.20 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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

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Related Compounds

2-N,2-N-diethyl-4-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80765267
4-N-cyclohexyl-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80766155
6-chloro-2-N-(2-methylcyclopropyl)-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80826573
6-butylsulfanyl-2-N,2-N-diethyl-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80884317
4-[[4-(diethylamino)-6-(pyridin-3-ylmethylamino)-1,3,5-triazin-2-yl]amino]cyclohexan-1-ol
CID 117093528
4-N-(2-cyclopropylethyl)-2-N,2-N,6-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80847684
3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
CID 106138050
2-N,2-N-dimethyl-6-N-propyl-4-N-(thiolan-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 103065188
3-[[2-(propylamino)-7H-purin-6-yl]amino]cyclobutan-1-ol
CID 114785530
4-N,4-N-diethyl-6-(2-methylpyrrolidin-1-yl)-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80774325
2-N-ethyl-4-N,4-N-dimethyl-2-N,6-N-dipropyl-1,3,5-triazine-2,4,6-triamine
CID 80774261
2-N,2-N-diethyl-4-N-(1-methoxypropan-2-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80771079

Frequently Asked Questions

What is the IUPAC name of 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol?
The IUPAC name of 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol (CID 80832237) is 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol.
What is the SMILES notation for 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol?
The canonical SMILES for 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol is CCCNc1nc(NC2CC(O)C2)nc(N(CC)CC)n1.
What is the InChIKey of 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol?
The InChIKey is RCZFYBCMLZMGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6O/c1-4-7-15-12-17-13(16-10-8-11(21)9-10)19-14(18-12)20(5-2)6-3/h10-11,21H,4-9H2,1-3H3,(H2,15,16,17,18,19).
What are the key properties of 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol?
3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol has a molecular weight of 294.40 g/mol, XLogP of 1.47, 8 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(diethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol is sourced from PubChem (CID 80832237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).