2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide

C7H15N5O — CID 104883713

IUPAC2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide
SMILESCNC(=O)C/N=C(\NN)NC1CC1
InChIInChI=1S/C7H15N5O/c1-9-6(13)4-10-7(12-8)11-5-2-3-5/h5H,2-4,8H2,1H3,(H,9,13)(H2,10,11,12)
InChIKeyZXDFYGKRDFPESW-UHFFFAOYSA-N
MW185.23 g/mol
LogP-1.70
Rot. Bonds3

About 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide

2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide (PubChem CID 104883713) has the molecular formula C7H15N5O and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide
PubChem CID104883713
Molecular FormulaC7H15N5O
Molecular Weight185.23 g/mol
Exact Mass185.13
IUPAC Name2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide
SMILESCNC(=O)C/N=C(\NN)NC1CC1
InChIInChI=1S/C7H15N5O/c1-9-6(13)4-10-7(12-8)11-5-2-3-5/h5H,2-4,8H2,1H3,(H,9,13)(H2,10,11,12)
InChIKeyZXDFYGKRDFPESW-UHFFFAOYSA-N
XLogP-1.70
TPSA91.54 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-1.70
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[[(cyclopentylamino)-hydrazinylmethylidene]amino]-N-ethylacetamide
CID 104883990
N-cyclopropyl-2-[[hydrazinyl(propylamino)methylidene]amino]acetamide
CID 104883956
2-[[(cyclopentylamino)-hydrazinylmethylidene]amino]acetamide
CID 104882876
2-[[(cyclopropylamino)-(ethylamino)methylidene]amino]-N-ethylacetamide;hydroiodide
CID 110989030
1-amino-2-ethyl-3-(4-propylcyclohexyl)guanidine
CID 104885055
3-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N,N-diethylpropanamide
CID 104888373
1-amino-3-cyclopropyl-2-(2-cyclopropylethyl)guanidine
CID 104887133
2-[[(cyclopentylamino)-(ethylamino)methylidene]amino]-N-cyclopropylacetamide;hydroiodide
CID 110992178
1-amino-3-cyclopropyl-2-[(4-methylcyclohexyl)methyl]guanidine
CID 104885819
1-amino-3-cyclopropyl-2-methylguanidine;hydroiodide
CID 67070956
N-tert-butyl-3-[[(cyclopentylamino)-hydrazinylmethylidene]amino]propanamide
CID 104888342
1-amino-3-cyclopropyl-2-[(1-methylcyclopentyl)methyl]guanidine
CID 104886020

Frequently Asked Questions

What is the IUPAC name of 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide?
The IUPAC name of 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide (CID 104883713) is 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide.
What is the SMILES notation for 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide?
The canonical SMILES for 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide is CNC(=O)C/N=C(\NN)NC1CC1.
What is the InChIKey of 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide?
The InChIKey is ZXDFYGKRDFPESW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N5O/c1-9-6(13)4-10-7(12-8)11-5-2-3-5/h5H,2-4,8H2,1H3,(H,9,13)(H2,10,11,12).
What are the key properties of 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide?
2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide has a molecular weight of 185.23 g/mol, XLogP of -1.70, 3 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(cyclopropylamino)-hydrazinylmethylidene]amino]-N-methylacetamide is sourced from PubChem (CID 104883713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).