N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide

C10H20N4O2 — CID 63582922

IUPACN-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide
SMILESCC(CC(=O)NN)N(C)CC(=O)NC1CC1
InChIInChI=1S/C10H20N4O2/c1-7(5-9(15)13-11)14(2)6-10(16)12-8-3-4-8/h7-8H,3-6,11H2,1-2H3,(H,12,16)(H,13,15)
InChIKeyARYCCUMXALXJIM-UHFFFAOYSA-N
MW228.30 g/mol
LogP-1.03
Rot. Bonds6

About N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide

N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide (PubChem CID 63582922) has the molecular formula C10H20N4O2 and a molecular weight of 228.30 g/mol. Its IUPAC name is N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide
PubChem CID63582922
Molecular FormulaC10H20N4O2
Molecular Weight228.30 g/mol
Exact Mass228.16
IUPAC NameN-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide
SMILESCC(CC(=O)NN)N(C)CC(=O)NC1CC1
InChIInChI=1S/C10H20N4O2/c1-7(5-9(15)13-11)14(2)6-10(16)12-8-3-4-8/h7-8H,3-6,11H2,1-2H3,(H,12,16)(H,13,15)
InChIKeyARYCCUMXALXJIM-UHFFFAOYSA-N
XLogP-1.03
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 5-1.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

N-cyclopropyl-2-[(1-hydrazinyl-1-oxopropan-2-yl)-methylamino]acetamide
CID 63584391
2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]-N,N-dimethylacetamide
CID 63573657
3-[cyclopentylmethyl(methyl)amino]butanehydrazide
CID 63656548
2-[1-cyanoethyl(methyl)amino]-N-cyclopropylacetamide
CID 60670090
ethyl 2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]butanoate
CID 64661878
2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-cyclopropylacetamide
CID 116652957
2-[1-cyanopropan-2-yl(methyl)amino]-N-cyclopentylacetamide
CID 63228388
3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]butanehydrazide
CID 79317659
(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide
CID 78972028
3-[2,2-dimethylpropyl(methyl)amino]butanehydrazide
CID 63578194
2-[[2-(cyclopentylamino)-2-oxoethyl]-methylamino]propanoic acid;hydrochloride
CID 119913701
(2S)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N,3-dimethylpentanamide
CID 61173174

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide (CID 63582922) is N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide is CC(CC(=O)NN)N(C)CC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide?
The InChIKey is ARYCCUMXALXJIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O2/c1-7(5-9(15)13-11)14(2)6-10(16)12-8-3-4-8/h7-8H,3-6,11H2,1-2H3,(H,12,16)(H,13,15).
What are the key properties of N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide?
N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide has a molecular weight of 228.30 g/mol, XLogP of -1.03, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(4-hydrazinyl-4-oxobutan-2-yl)-methylamino]acetamide is sourced from PubChem (CID 63582922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).