5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol

C11H21N5O2 — CID 107207623

IUPAC5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol
SMILESCOc1c(NN)ncnc1N(C)CCCCCO
InChIInChI=1S/C11H21N5O2/c1-16(6-4-3-5-7-17)11-9(18-2)10(15-12)13-8-14-11/h8,17H,3-7,12H2,1-2H3,(H,13,14,15)
InChIKeyUKUIVZCCCQCCAM-UHFFFAOYSA-N
MW255.32 g/mol
LogP0.37
Rot. Bonds8

About 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol

5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol (PubChem CID 107207623) has the molecular formula C11H21N5O2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol.

Molecular Properties

Compound Name5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol
PubChem CID107207623
Molecular FormulaC11H21N5O2
Molecular Weight255.32 g/mol
Exact Mass255.17
IUPAC Name5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol
SMILESCOc1c(NN)ncnc1N(C)CCCCCO
InChIInChI=1S/C11H21N5O2/c1-16(6-4-3-5-7-17)11-9(18-2)10(15-12)13-8-14-11/h8,17H,3-7,12H2,1-2H3,(H,13,14,15)
InChIKeyUKUIVZCCCQCCAM-UHFFFAOYSA-N
XLogP0.37
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol with MolForge

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Related Compounds

5-[methyl-[5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol
CID 107207443
2-[cyclobutyl-(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]ethanol
CID 102875852
5-[methyl-[6-(methylamino)-5-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol
CID 107207555
6-hydrazinyl-N-(3-methoxypropyl)-N,5-dimethylpyrimidin-4-amine
CID 80913732
5-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)-methylamino]pentan-1-ol
CID 107207622
3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-4-methylpentan-1-ol
CID 106358434
2-[2-[(6-amino-5-methoxypyrimidin-4-yl)-methylamino]ethoxy]ethanol
CID 114243853
5-[(6-chloro-5-methoxypyrimidin-4-yl)amino]pentan-1-ol
CID 107318311
2-[(6-hydrazinyl-5-nitropyrimidin-4-yl)-methylamino]ethanol
CID 80943199
5-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]pentan-1-ol
CID 107207600
5-[(2-hydrazinylquinazolin-4-yl)-methylamino]pentan-1-ol
CID 107207592
N-(cyclobutylmethyl)-N-ethyl-6-hydrazinyl-5-methoxypyrimidin-4-amine
CID 107403222

Frequently Asked Questions

What is the IUPAC name of 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol?
The IUPAC name of 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol (CID 107207623) is 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol.
What is the SMILES notation for 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol?
The canonical SMILES for 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol is COc1c(NN)ncnc1N(C)CCCCCO.
What is the InChIKey of 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol?
The InChIKey is UKUIVZCCCQCCAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O2/c1-16(6-4-3-5-7-17)11-9(18-2)10(15-12)13-8-14-11/h8,17H,3-7,12H2,1-2H3,(H,13,14,15).
What are the key properties of 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol?
5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol has a molecular weight of 255.32 g/mol, XLogP of 0.37, 8 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)-methylamino]pentan-1-ol is sourced from PubChem (CID 107207623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).