2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide

C11H24N4O4 — CID 3743875

IUPAC2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide
SMILESCC(C)OCC(O)CC(CCC(=O)NN)C(=O)NN
InChIInChI=1S/C11H24N4O4/c1-7(2)19-6-9(16)5-8(11(18)15-13)3-4-10(17)14-12/h7-9,16H,3-6,12-13H2,1-2H3,(H,14,17)(H,15,18)
InChIKeySDQOUUBRWSSTRL-UHFFFAOYSA-N
MW276.34 g/mol
LogP-1.46
Rot. Bonds9

About 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide

2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide (PubChem CID 3743875) has the molecular formula C11H24N4O4 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide.

Molecular Properties

Compound Name2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide
PubChem CID3743875
Molecular FormulaC11H24N4O4
Molecular Weight276.34 g/mol
Exact Mass276.18
IUPAC Name2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide
SMILESCC(C)OCC(O)CC(CCC(=O)NN)C(=O)NN
InChIInChI=1S/C11H24N4O4/c1-7(2)19-6-9(16)5-8(11(18)15-13)3-4-10(17)14-12/h7-9,16H,3-6,12-13H2,1-2H3,(H,14,17)(H,15,18)
InChIKeySDQOUUBRWSSTRL-UHFFFAOYSA-N
XLogP-1.46
TPSA139.70 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 5-1.46
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

(3R,5S)-heptane-1,3,5,7-tetracarbohydrazide
CID 102254875
2-(3-butoxy-2-hydroxypropyl)pentanedihydrazide
CID 3100698
pentane-1,3,5-tricarbohydrazide
CID 18368507
2-(3-aminopropyl)-4-hydroxy-5-propan-2-yloxypentanoic acid
CID 104681093
(2-hydroxy-3-propan-2-yloxypropyl) 4-methylpentanoate
CID 156555309
diethyl 2-(2-hydroxy-3-propan-2-yloxypropyl)propanedioate
CID 112696152
(2R)-2-aminopentanedihydrazide
CID 13018201
2-benzyl-4-hydroxy-5-(3-methylbutoxy)pentanehydrazide;oxalic acid
CID 128963437
3-methylhexanedihydrazide
CID 141312622
3-hydroxy-4-propan-2-yloxybutanoic acid
CID 65416827
(2R)-1-[[(2R)-2-hydroxy-3-propan-2-yloxypropyl]amino]-3-propan-2-yloxypropan-2-ol
CID 38999921
(2R)-1-fluoro-3-propan-2-yloxypropan-2-ol
CID 158358225

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide?
The IUPAC name of 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide (CID 3743875) is 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide.
What is the SMILES notation for 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide?
The canonical SMILES for 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide is CC(C)OCC(O)CC(CCC(=O)NN)C(=O)NN.
What is the InChIKey of 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide?
The InChIKey is SDQOUUBRWSSTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O4/c1-7(2)19-6-9(16)5-8(11(18)15-13)3-4-10(17)14-12/h7-9,16H,3-6,12-13H2,1-2H3,(H,14,17)(H,15,18).
What are the key properties of 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide?
2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide has a molecular weight of 276.34 g/mol, XLogP of -1.46, 9 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-3-propan-2-yloxypropyl)pentanedihydrazide is sourced from PubChem (CID 3743875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).