[1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol

C9H16N6O2 — CID 112629745

IUPAC[1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol
SMILESCOc1nc(NN)nc(N2CCC(CO)C2)n1
InChIInChI=1S/C9H16N6O2/c1-17-9-12-7(14-10)11-8(13-9)15-3-2-6(4-15)5-16/h6,16H,2-5,10H2,1H3,(H,11,12,13,14)
InChIKeyMCWJWKNMWZKUJP-UHFFFAOYSA-N
MW240.27 g/mol
LogP-1.02
Rot. Bonds4

About [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol

[1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol (PubChem CID 112629745) has the molecular formula C9H16N6O2 and a molecular weight of 240.27 g/mol. Its IUPAC name is [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol
PubChem CID112629745
Molecular FormulaC9H16N6O2
Molecular Weight240.27 g/mol
Exact Mass240.13
IUPAC Name[1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol
SMILESCOc1nc(NN)nc(N2CCC(CO)C2)n1
InChIInChI=1S/C9H16N6O2/c1-17-9-12-7(14-10)11-8(13-9)15-3-2-6(4-15)5-16/h6,16H,2-5,10H2,1H3,(H,11,12,13,14)
InChIKeyMCWJWKNMWZKUJP-UHFFFAOYSA-N
XLogP-1.02
TPSA109.42 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 5-1.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol
CID 115967487
[1-[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]piperidin-4-yl]methanol
CID 80757527
[1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)-3-methylpyrrolidin-2-yl]methanol
CID 102790017
2-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 81108983
[4-(2,6-dimethylthiomorpholin-4-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
CID 80912272
[4-methoxy-6-(4-methylsulfanylazepan-1-yl)-1,3,5-triazin-2-yl]hydrazine
CID 114238717
[4-ethoxy-6-(3-methylpyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazine
CID 80899195
ethyl 4-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)piperazine-1-carboxylate
CID 107877882
1-(4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-yl)-4-methylpiperidin-3-ol
CID 102971920
[4-methoxy-6-(4-propan-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]hydrazine
CID 80907116
[4-(4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-yl)morpholin-2-yl]methanol
CID 81218495
1-(4-hydrazinyl-6-propoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-3-ol
CID 102971915

Frequently Asked Questions

What is the IUPAC name of [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol?
The IUPAC name of [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol (CID 112629745) is [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol is COc1nc(NN)nc(N2CCC(CO)C2)n1.
What is the InChIKey of [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol?
The InChIKey is MCWJWKNMWZKUJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N6O2/c1-17-9-12-7(14-10)11-8(13-9)15-3-2-6(4-15)5-16/h6,16H,2-5,10H2,1H3,(H,11,12,13,14).
What are the key properties of [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol?
[1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol has a molecular weight of 240.27 g/mol, XLogP of -1.02, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 112629745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).