N'-(2-aminoacetyl)cyclopropanecarbohydrazide

C6H11N3O2 — CID 82111219

IUPACN'-(2-aminoacetyl)cyclopropanecarbohydrazide
SMILESNCC(=O)NNC(=O)C1CC1
InChIInChI=1S/C6H11N3O2/c7-3-5(10)8-9-6(11)4-1-2-4/h4H,1-3,7H2,(H,8,10)(H,9,11)
InChIKeyKVGSOWAJPTXHAO-UHFFFAOYSA-N
MW157.17 g/mol
LogP-1.50
Rot. Bonds2

About N'-(2-aminoacetyl)cyclopropanecarbohydrazide

N'-(2-aminoacetyl)cyclopropanecarbohydrazide (PubChem CID 82111219) has the molecular formula C6H11N3O2 and a molecular weight of 157.17 g/mol. Its IUPAC name is N'-(2-aminoacetyl)cyclopropanecarbohydrazide.

Molecular Properties

Compound NameN'-(2-aminoacetyl)cyclopropanecarbohydrazide
PubChem CID82111219
Molecular FormulaC6H11N3O2
Molecular Weight157.17 g/mol
Exact Mass157.09
IUPAC NameN'-(2-aminoacetyl)cyclopropanecarbohydrazide
SMILESNCC(=O)NNC(=O)C1CC1
InChIInChI=1S/C6H11N3O2/c7-3-5(10)8-9-6(11)4-1-2-4/h4H,1-3,7H2,(H,8,10)(H,9,11)
InChIKeyKVGSOWAJPTXHAO-UHFFFAOYSA-N
XLogP-1.50
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 5-1.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2-aminoacetyl)cyclopropanecarbohydrazide?
The IUPAC name of N'-(2-aminoacetyl)cyclopropanecarbohydrazide (CID 82111219) is N'-(2-aminoacetyl)cyclopropanecarbohydrazide.
What is the SMILES notation for N'-(2-aminoacetyl)cyclopropanecarbohydrazide?
The canonical SMILES for N'-(2-aminoacetyl)cyclopropanecarbohydrazide is NCC(=O)NNC(=O)C1CC1.
What is the InChIKey of N'-(2-aminoacetyl)cyclopropanecarbohydrazide?
The InChIKey is KVGSOWAJPTXHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O2/c7-3-5(10)8-9-6(11)4-1-2-4/h4H,1-3,7H2,(H,8,10)(H,9,11).
What are the key properties of N'-(2-aminoacetyl)cyclopropanecarbohydrazide?
N'-(2-aminoacetyl)cyclopropanecarbohydrazide has a molecular weight of 157.17 g/mol, XLogP of -1.50, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-aminoacetyl)cyclopropanecarbohydrazide is sourced from PubChem (CID 82111219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).