4-[cycloheptyl(methyl)amino]butanehydrazide

C12H25N3O — CID 63571638

IUPAC4-[cycloheptyl(methyl)amino]butanehydrazide
SMILESCN(CCCC(=O)NN)C1CCCCCC1
InChIInChI=1S/C12H25N3O/c1-15(10-6-9-12(16)14-13)11-7-4-2-3-5-8-11/h11H,2-10,13H2,1H3,(H,14,16)
InChIKeyFNKXFHNEWJPEAQ-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.41
Rot. Bonds5

About 4-[cycloheptyl(methyl)amino]butanehydrazide

4-[cycloheptyl(methyl)amino]butanehydrazide (PubChem CID 63571638) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 4-[cycloheptyl(methyl)amino]butanehydrazide.

Molecular Properties

Compound Name4-[cycloheptyl(methyl)amino]butanehydrazide
PubChem CID63571638
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name4-[cycloheptyl(methyl)amino]butanehydrazide
SMILESCN(CCCC(=O)NN)C1CCCCCC1
InChIInChI=1S/C12H25N3O/c1-15(10-6-9-12(16)14-13)11-7-4-2-3-5-8-11/h11H,2-10,13H2,1H3,(H,14,16)
InChIKeyFNKXFHNEWJPEAQ-UHFFFAOYSA-N
XLogP1.41
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-[cycloheptyl(methyl)amino]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

4-[cyclohexyl(methyl)amino]butanehydrazide
CID 63568701
2-[cycloheptyl(methyl)amino]acetohydrazide
CID 63574269
4-[(2-hydroxycyclohexyl)-methylamino]butanehydrazide
CID 102638791
6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide
CID 60981769
N-(2-aminophenyl)-4-[cyclohexyl(methyl)amino]butanamide
CID 16794531
3-[cyclododecyl(methyl)amino]propanoic acid
CID 65063573
6-[methyl(oxolan-3-yl)amino]hexanehydrazide
CID 82753777
N-[2-[cyclohexyl(methyl)amino]ethyl]pentanamide
CID 86848662
4-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]butanamide
CID 63316373
4-[(4-aminocyclohexyl)-methylamino]-N-methylbutanamide
CID 79120771
4-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]butanamide;dihydrochloride
CID 119878781
6-[cyclobutyl(3-hydroxypropyl)amino]hexanehydrazide
CID 102873673

Frequently Asked Questions

What is the IUPAC name of 4-[cycloheptyl(methyl)amino]butanehydrazide?
The IUPAC name of 4-[cycloheptyl(methyl)amino]butanehydrazide (CID 63571638) is 4-[cycloheptyl(methyl)amino]butanehydrazide.
What is the SMILES notation for 4-[cycloheptyl(methyl)amino]butanehydrazide?
The canonical SMILES for 4-[cycloheptyl(methyl)amino]butanehydrazide is CN(CCCC(=O)NN)C1CCCCCC1.
What is the InChIKey of 4-[cycloheptyl(methyl)amino]butanehydrazide?
The InChIKey is FNKXFHNEWJPEAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-15(10-6-9-12(16)14-13)11-7-4-2-3-5-8-11/h11H,2-10,13H2,1H3,(H,14,16).
What are the key properties of 4-[cycloheptyl(methyl)amino]butanehydrazide?
4-[cycloheptyl(methyl)amino]butanehydrazide has a molecular weight of 227.35 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cycloheptyl(methyl)amino]butanehydrazide is sourced from PubChem (CID 63571638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).