4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide

C11H24N4O2 — CID 66051201

IUPAC4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide
SMILESCN(C)CC1CC(O)CN1CCCC(=O)NN
InChIInChI=1S/C11H24N4O2/c1-14(2)7-9-6-10(16)8-15(9)5-3-4-11(17)13-12/h9-10,16H,3-8,12H2,1-2H3,(H,13,17)
InChIKeyYSHVZGLYGPFECN-UHFFFAOYSA-N
MW244.34 g/mol
LogP-1.25
Rot. Bonds6

About 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide

4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide (PubChem CID 66051201) has the molecular formula C11H24N4O2 and a molecular weight of 244.34 g/mol. Its IUPAC name is 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide.

Molecular Properties

Compound Name4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide
PubChem CID66051201
Molecular FormulaC11H24N4O2
Molecular Weight244.34 g/mol
Exact Mass244.19
IUPAC Name4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide
SMILESCN(C)CC1CC(O)CN1CCCC(=O)NN
InChIInChI=1S/C11H24N4O2/c1-14(2)7-9-6-10(16)8-15(9)5-3-4-11(17)13-12/h9-10,16H,3-8,12H2,1-2H3,(H,13,17)
InChIKeyYSHVZGLYGPFECN-UHFFFAOYSA-N
XLogP-1.25
TPSA81.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 5-1.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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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Frequently Asked Questions

What is the IUPAC name of 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide?
The IUPAC name of 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide (CID 66051201) is 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide.
What is the SMILES notation for 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide?
The canonical SMILES for 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide is CN(C)CC1CC(O)CN1CCCC(=O)NN.
What is the InChIKey of 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide?
The InChIKey is YSHVZGLYGPFECN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2/c1-14(2)7-9-6-10(16)8-15(9)5-3-4-11(17)13-12/h9-10,16H,3-8,12H2,1-2H3,(H,13,17).
What are the key properties of 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide?
4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide has a molecular weight of 244.34 g/mol, XLogP of -1.25, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(dimethylamino)methyl]-4-hydroxypyrrolidin-1-yl]butanehydrazide is sourced from PubChem (CID 66051201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).