3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol

C11H21N5O — CID 106179542

IUPAC3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol
SMILESCCC(C)(CCO)Nc1cc(C)nc(NN)n1
InChIInChI=1S/C11H21N5O/c1-4-11(3,5-6-17)15-9-7-8(2)13-10(14-9)16-12/h7,17H,4-6,12H2,1-3H3,(H2,13,14,15,16)
InChIKeyUUYBAPGJANXMNH-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.03
Rot. Bonds6

About 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol

3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol (PubChem CID 106179542) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol.

Molecular Properties

Compound Name3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol
PubChem CID106179542
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol
SMILESCCC(C)(CCO)Nc1cc(C)nc(NN)n1
InChIInChI=1S/C11H21N5O/c1-4-11(3,5-6-17)15-9-7-8(2)13-10(14-9)16-12/h7,17H,4-6,12H2,1-3H3,(H2,13,14,15,16)
InChIKeyUUYBAPGJANXMNH-UHFFFAOYSA-N
XLogP1.03
TPSA96.09 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-methyl-3-[[2-(methylamino)-6-(trifluoromethyl)pyrimidin-4-yl]amino]pentan-1-ol
CID 106179204
2-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-2-methylpropanamide
CID 80903386
3-[(6-amino-2-ethylpyrimidin-4-yl)amino]-3-methylpentan-1-ol
CID 106179255
2-N-(2,6-dimethylpyrimidin-4-yl)-2-methylbutane-1,2-diamine
CID 64551143
3-methyl-3-[(4-methylpyrimidin-2-yl)amino]pentan-1-ol
CID 103768344
4-[(1-hydroxy-3-methylpentan-3-yl)amino]-2-methyl-1H-pyrimidin-6-one
CID 136849675
3-methyl-3-[(4-methyl-6-propoxypyrimidin-2-yl)amino]pentan-1-ol
CID 106177820
2-N-(4,6-dimethylpyrimidin-2-yl)-2-methylbutane-1,2-diamine
CID 64549694
3-methyl-3-[[6-(methylamino)-2-methylsulfanylpyrimidin-4-yl]amino]pentan-1-ol
CID 106179091
3-[(6-aminopyridazin-3-yl)amino]-3-methylpentan-1-ol
CID 106174456
(2S)-2-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylbutan-1-ol
CID 80923311
3-[[2-cyclopropyl-6-(propylamino)pyrimidin-4-yl]amino]-3-methylpentan-1-ol
CID 106179075

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol?
The IUPAC name of 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol (CID 106179542) is 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol.
What is the SMILES notation for 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol?
The canonical SMILES for 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol is CCC(C)(CCO)Nc1cc(C)nc(NN)n1.
What is the InChIKey of 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol?
The InChIKey is UUYBAPGJANXMNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-4-11(3,5-6-17)15-9-7-8(2)13-10(14-9)16-12/h7,17H,4-6,12H2,1-3H3,(H2,13,14,15,16).
What are the key properties of 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol?
3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol has a molecular weight of 239.32 g/mol, XLogP of 1.03, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-3-methylpentan-1-ol is sourced from PubChem (CID 106179542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).