5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide

C12H25N3O — CID 107402397

IUPAC5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide
SMILESCCN(CCCCC(=O)NN)CC1CCC1
InChIInChI=1S/C12H25N3O/c1-2-15(10-11-6-5-7-11)9-4-3-8-12(16)14-13/h11H,2-10,13H2,1H3,(H,14,16)
InChIKeyWPSRTJZGSFELIJ-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.27
Rot. Bonds8

About 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide

5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide (PubChem CID 107402397) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide.

Molecular Properties

Compound Name5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide
PubChem CID107402397
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide
SMILESCCN(CCCCC(=O)NN)CC1CCC1
InChIInChI=1S/C12H25N3O/c1-2-15(10-11-6-5-7-11)9-4-3-8-12(16)14-13/h11H,2-10,13H2,1H3,(H,14,16)
InChIKeyWPSRTJZGSFELIJ-UHFFFAOYSA-N
XLogP1.27
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-[cyclopropylmethyl(ethyl)amino]pentanehydrazide
CID 63940685
3-[cyclobutylmethyl(ethyl)amino]propanehydrazide
CID 107402379
6-[3-(diethylamino)propyl-ethylamino]hexanehydrazide
CID 102998195
3-[cyclobutylmethyl(ethyl)amino]propan-1-ol
CID 115666204
6-[cyclopropyl(cyclopropylmethyl)amino]hexanehydrazide
CID 64520123
4-[cycloheptyl(methyl)amino]butanehydrazide
CID 63571638
4-[cyclohexyl(methyl)amino]butanehydrazide
CID 63568701
N'-(cyclobutylmethyl)-N,N'-diethylpropane-1,3-diamine
CID 107398006
6-[cyclobutylmethyl(ethyl)amino]-2-(cyclopropylamino)-2-methylhexanoic acid
CID 107401160
3-[cyclopropylmethyl(methyl)amino]propanehydrazide
CID 63571724
6-[cyclobutyl(3-hydroxypropyl)amino]hexanehydrazide
CID 102873673
5-[cyclobutylmethyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 107401112

Frequently Asked Questions

What is the IUPAC name of 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide?
The IUPAC name of 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide (CID 107402397) is 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide.
What is the SMILES notation for 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide?
The canonical SMILES for 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide is CCN(CCCCC(=O)NN)CC1CCC1.
What is the InChIKey of 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide?
The InChIKey is WPSRTJZGSFELIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-2-15(10-11-6-5-7-11)9-4-3-8-12(16)14-13/h11H,2-10,13H2,1H3,(H,14,16).
What are the key properties of 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide?
5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide has a molecular weight of 227.35 g/mol, XLogP of 1.27, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclobutylmethyl(ethyl)amino]pentanehydrazide is sourced from PubChem (CID 107402397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).