2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide

C12H25N3O — CID 83048058

IUPAC2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide
SMILESCCCC(C(=O)NN)N(CC(C)C)C1CC1
InChIInChI=1S/C12H25N3O/c1-4-5-11(12(16)14-13)15(8-9(2)3)10-6-7-10/h9-11H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyNKEOIGARABHYQL-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.27
Rot. Bonds7

About 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide

2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide (PubChem CID 83048058) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide.

Molecular Properties

Compound Name2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide
PubChem CID83048058
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide
SMILESCCCC(C(=O)NN)N(CC(C)C)C1CC1
InChIInChI=1S/C12H25N3O/c1-4-5-11(12(16)14-13)15(8-9(2)3)10-6-7-10/h9-11H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyNKEOIGARABHYQL-UHFFFAOYSA-N
XLogP1.27
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
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': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[cyclopropyl(2-methylpropyl)amino]butanehydrazide
CID 63584160
2-[cyclopropyl(2-hydroxyethyl)amino]pentanehydrazide
CID 83047676
2-[cyclopentyl(2-methylpropyl)amino]pentanoic acid
CID 83048898
ethyl 2-[cyclopropyl(2-methylpropyl)amino]butanoate
CID 64661063
2-[cyclohexyl(methyl)amino]pentanehydrazide
CID 83047526
2-[cyclopropyl(methyl)amino]butanehydrazide
CID 63573257
2-[methyl(oxolan-3-yl)amino]pentanehydrazide
CID 83047683
2-[bis(2-methylpropyl)amino]butanehydrazide
CID 63585587
2-[cyclobutyl(3-hydroxypropyl)amino]butanehydrazide
CID 102873674
ethyl 2-[cyclopentyl(3-methylbutyl)amino]pentanoate
CID 83049195
4-N-cyclopropyl-4-N-(2-methylpropyl)pentane-1,4-diamine
CID 62430254
2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentanehydrazide
CID 83048313

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide?
The IUPAC name of 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide (CID 83048058) is 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide.
What is the SMILES notation for 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide?
The canonical SMILES for 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide is CCCC(C(=O)NN)N(CC(C)C)C1CC1.
What is the InChIKey of 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide?
The InChIKey is NKEOIGARABHYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-4-5-11(12(16)14-13)15(8-9(2)3)10-6-7-10/h9-11H,4-8,13H2,1-3H3,(H,14,16).
What are the key properties of 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide?
2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide has a molecular weight of 227.35 g/mol, XLogP of 1.27, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(2-methylpropyl)amino]pentanehydrazide is sourced from PubChem (CID 83048058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).