4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide

C11H23N3O2 — CID 102638791

IUPAC4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide
SMILESCN(CCCC(=O)NN)C1CCCCC1O
InChIInChI=1S/C11H23N3O2/c1-14(8-4-7-11(16)13-12)9-5-2-3-6-10(9)15/h9-10,15H,2-8,12H2,1H3,(H,13,16)
InChIKeyJOVLPBBAEASTDW-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.01
Rot. Bonds5

About 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide

4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide (PubChem CID 102638791) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide.

Molecular Properties

Compound Name4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide
PubChem CID102638791
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide
SMILESCN(CCCC(=O)NN)C1CCCCC1O
InChIInChI=1S/C11H23N3O2/c1-14(8-4-7-11(16)13-12)9-5-2-3-6-10(9)15/h9-10,15H,2-8,12H2,1H3,(H,13,16)
InChIKeyJOVLPBBAEASTDW-UHFFFAOYSA-N
XLogP-0.01
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.01
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'}

Analyze 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(2-hydroxy-3-trimethylstannylcyclohexyl)propanehydrazide
CID 70588410
N'-(2-hydroxycyclohexyl)-3-trimethylstannylpropanehydrazide
CID 70588705
N'-(2-hydroxycyclohexyl)-N'-(2-hydroxy-3-trimethylstannylcyclohexyl)propanehydrazide
CID 70601166
4-[(2-hydroxycyclohexyl)amino]-N,N-dimethylbutanamide
CID 62360580
4-[2-Hydroxypropyl(methyl)amino]pentanehydrazide
CID 63571471
4-[Cyclohexyl(2-hydroxyethyl)amino]butanehydrazide
CID 63583099
4-[Cyclohexyl(2-hydroxyethyl)amino]pentanehydrazide
CID 63584023
3-[Cyclohexyl(2-hydroxyethyl)amino]butanehydrazide
CID 63584024
4-[2-(Hydroxymethyl)piperidin-1-yl]butanehydrazide
CID 63584063
5-[2-(Hydroxymethyl)piperidin-1-yl]pentanehydrazide
CID 63584070
4-[2-(Hydroxymethyl)piperidin-1-yl]pentanehydrazide
CID 63584237
3-[2-(Hydroxymethyl)piperidin-1-yl]butanehydrazide
CID 63584238

Frequently Asked Questions

What is the IUPAC name of 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide?
The IUPAC name of 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide (CID 102638791) is 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide.
What is the SMILES notation for 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide?
The canonical SMILES for 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide is CN(CCCC(=O)NN)C1CCCCC1O.
What is the InChIKey of 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide?
The InChIKey is JOVLPBBAEASTDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-14(8-4-7-11(16)13-12)9-5-2-3-6-10(9)15/h9-10,15H,2-8,12H2,1H3,(H,13,16).
What are the key properties of 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide?
4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide has a molecular weight of 229.32 g/mol, XLogP of -0.01, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide is sourced from PubChem (CID 102638791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).