3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide

C10H23N3O2 — CID 79630779

IUPAC3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide
SMILESCCCN(CCO)CC(C)(C)C(=O)NN
InChIInChI=1S/C10H23N3O2/c1-4-5-13(6-7-14)8-10(2,3)9(15)12-11/h14H,4-8,11H2,1-3H3,(H,12,15)
InChIKeyVBGCIZWAECRZRQ-UHFFFAOYSA-N
MW217.31 g/mol
LogP-0.29
Rot. Bonds7

About 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide

3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide (PubChem CID 79630779) has the molecular formula C10H23N3O2 and a molecular weight of 217.31 g/mol. Its IUPAC name is 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide.

Molecular Properties

Compound Name3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide
PubChem CID79630779
Molecular FormulaC10H23N3O2
Molecular Weight217.31 g/mol
Exact Mass217.18
IUPAC Name3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide
SMILESCCCN(CCO)CC(C)(C)C(=O)NN
InChIInChI=1S/C10H23N3O2/c1-4-5-13(6-7-14)8-10(2,3)9(15)12-11/h14H,4-8,11H2,1-3H3,(H,12,15)
InChIKeyVBGCIZWAECRZRQ-UHFFFAOYSA-N
XLogP-0.29
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

3-[ethyl(2-hydroxyethyl)amino]-2,2-dimethylpropanehydrazide
CID 79626659
3-[ethyl(2,2,2-trifluoroethyl)amino]-2,2-dimethylpropanehydrazide
CID 79626181
3-[bis(2-hydroxyethyl)amino]-2,2-dimethylpropanoic acid
CID 22902542
3-[3-hydroxypropyl(propan-2-yl)amino]-2,2-dimethylpropanehydrazide
CID 79630977
2-[(3-bromo-2,2-dimethylpropyl)-propylamino]ethanol
CID 64999932
3-[2-hydroxyethyl(propyl)amino]-2-methylpropanehydrazide
CID 63583614
2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol
CID 62260772
3-amino-2,2-dimethylpropanehydrazide
CID 115426740
2,2-difluoro-3-[methyl(propyl)amino]propanehydrazide
CID 165463796
2-[ethyl(2-hydroxyethyl)amino]ethanol;2-[ethyl(propyl)amino]ethanol
CID 161297591
4-fluoro-3-[[2-hydroxyethyl(propyl)amino]methyl]benzohydrazide
CID 107458527
2-[[2-methyl-2-(propylaminomethyl)pentyl]-propylamino]ethanol
CID 62260774

Frequently Asked Questions

What is the IUPAC name of 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide?
The IUPAC name of 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide (CID 79630779) is 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide.
What is the SMILES notation for 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide?
The canonical SMILES for 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide is CCCN(CCO)CC(C)(C)C(=O)NN.
What is the InChIKey of 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide?
The InChIKey is VBGCIZWAECRZRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2/c1-4-5-13(6-7-14)8-10(2,3)9(15)12-11/h14H,4-8,11H2,1-3H3,(H,12,15).
What are the key properties of 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide?
3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide has a molecular weight of 217.31 g/mol, XLogP of -0.29, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydroxyethyl(propyl)amino]-2,2-dimethylpropanehydrazide is sourced from PubChem (CID 79630779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).