2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol

C12H23N7O2 — CID 80898063

IUPAC2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol
SMILESCC(C)Oc1nc(NN)nc(N2CCN(CCO)CC2)n1
InChIInChI=1S/C12H23N7O2/c1-9(2)21-12-15-10(17-13)14-11(16-12)19-5-3-18(4-6-19)7-8-20/h9,20H,3-8,13H2,1-2H3,(H,14,15,16,17)
InChIKeyUTCMVHMAKVQHHM-UHFFFAOYSA-N
MW297.36 g/mol
LogP-0.94
Rot. Bonds6

About 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol

2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol (PubChem CID 80898063) has the molecular formula C12H23N7O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol
PubChem CID80898063
Molecular FormulaC12H23N7O2
Molecular Weight297.36 g/mol
Exact Mass297.19
IUPAC Name2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol
SMILESCC(C)Oc1nc(NN)nc(N2CCN(CCO)CC2)n1
InChIInChI=1S/C12H23N7O2/c1-9(2)21-12-15-10(17-13)14-11(16-12)19-5-3-18(4-6-19)7-8-20/h9,20H,3-8,13H2,1-2H3,(H,14,15,16,17)
InChIKeyUTCMVHMAKVQHHM-UHFFFAOYSA-N
XLogP-0.94
TPSA112.66 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol with MolForge

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Launch Full Analysis

Related Compounds

(4-piperazin-1-yl-6-propan-2-yloxy-1,3,5-triazin-2-yl)hydrazine
CID 80917805
[4-(4,4-dimethylpiperidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
CID 80919495
4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-1-methylpiperazin-2-one
CID 80915244
2-[4-[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-1,4-diazepan-1-yl]ethanol
CID 107226852
[4-(2,6-dimethylmorpholin-4-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
CID 80928474
[4-methoxy-6-(4-propan-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]hydrazine
CID 80907116
4-(4-ethylpiperazin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80761608
[4-(1-ethoxypropan-2-yloxy)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 103491759
2-chloro-4-(4-ethylpiperazin-1-yl)-6-propan-2-yloxy-1,3,5-triazine
CID 62869517
2-[1-[4-(methylamino)-6-propan-2-yloxy-1,3,5-triazin-2-yl]pyrrolidin-3-yl]ethanol
CID 114802852
[4-(4-methylpyrazol-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
CID 80901681
2-[4-(4-amino-6-propoxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol
CID 80778474

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol (CID 80898063) is 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol is CC(C)Oc1nc(NN)nc(N2CCN(CCO)CC2)n1.
What is the InChIKey of 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol?
The InChIKey is UTCMVHMAKVQHHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N7O2/c1-9(2)21-12-15-10(17-13)14-11(16-12)19-5-3-18(4-6-19)7-8-20/h9,20H,3-8,13H2,1-2H3,(H,14,15,16,17).
What are the key properties of 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol?
2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol has a molecular weight of 297.36 g/mol, XLogP of -0.94, 6 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)piperazin-1-yl]ethanol is sourced from PubChem (CID 80898063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).