2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol

C11H20N6O — CID 80810265

IUPAC2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol
SMILESCNc1nc(N(C)C)nc(N(CCO)C2CC2)n1
InChIInChI=1S/C11H20N6O/c1-12-9-13-10(16(2)3)15-11(14-9)17(6-7-18)8-4-5-8/h8,18H,4-7H2,1-3H3,(H,12,13,14,15)
InChIKeyPNFXWGRCLCXHRX-UHFFFAOYSA-N
MW252.32 g/mol
LogP-0.06
Rot. Bonds6

About 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol

2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol (PubChem CID 80810265) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol
PubChem CID80810265
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol
SMILESCNc1nc(N(C)C)nc(N(CCO)C2CC2)n1
InChIInChI=1S/C11H20N6O/c1-12-9-13-10(16(2)3)15-11(14-9)17(6-7-18)8-4-5-8/h8,18H,4-7H2,1-3H3,(H,12,13,14,15)
InChIKeyPNFXWGRCLCXHRX-UHFFFAOYSA-N
XLogP-0.06
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[cyclopropyl-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol
CID 80810577
2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-cyclopropylamino]ethanol
CID 80811019
2-N-butyl-2-N-cyclopropyl-6-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80799249
2-N-cyclopropyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80779582
2-N,4-N,4-N,6-N-tetramethyl-2-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80774094
[1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpyrrolidin-2-yl]methanol
CID 102789968
2-[cyclobutyl-[2-(methylamino)-6-(trifluoromethyl)pyrimidin-4-yl]amino]ethanol
CID 102875645
2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-methylamino]propan-1-ol
CID 113426550
2-[[4-chloro-6-(ethylamino)-1,3,5-triazin-2-yl]-cyclohexylamino]ethanol
CID 80811349
2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine
CID 80826128
2-N-(cyclopropylmethyl)-4-N,4-N,6-N-trimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
CID 80820992
2-[cyclobutyl-[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]amino]ethanol
CID 102875727

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The IUPAC name of 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol (CID 80810265) is 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol.
What is the SMILES notation for 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The canonical SMILES for 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol is CNc1nc(N(C)C)nc(N(CCO)C2CC2)n1.
What is the InChIKey of 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The InChIKey is PNFXWGRCLCXHRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-12-9-13-10(16(2)3)15-11(14-9)17(6-7-18)8-4-5-8/h8,18H,4-7H2,1-3H3,(H,12,13,14,15).
What are the key properties of 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol?
2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol has a molecular weight of 252.32 g/mol, XLogP of -0.06, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]ethanol is sourced from PubChem (CID 80810265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).