N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide

C14H26N4O4 — CID 56606505

IUPACN-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide
SMILESCCCC(=O)NCCCC(=O)NNC(=O)CCCNC(C)=O
InChIInChI=1S/C14H26N4O4/c1-3-6-12(20)16-10-5-8-14(22)18-17-13(21)7-4-9-15-11(2)19/h3-10H2,1-2H3,(H,15,19)(H,16,20)(H,17,21)(H,18,22)
InChIKeyWZMHGSKCTBFYFJ-UHFFFAOYSA-N
MW314.39 g/mol
LogP-0.25
Rot. Bonds10

About N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide

N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide (PubChem CID 56606505) has the molecular formula C14H26N4O4 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide.

Molecular Properties

Compound NameN-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide
PubChem CID56606505
Molecular FormulaC14H26N4O4
Molecular Weight314.39 g/mol
Exact Mass314.20
IUPAC NameN-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide
SMILESCCCC(=O)NCCCC(=O)NNC(=O)CCCNC(C)=O
InChIInChI=1S/C14H26N4O4/c1-3-6-12(20)16-10-5-8-14(22)18-17-13(21)7-4-9-15-11(2)19/h3-10H2,1-2H3,(H,15,19)(H,16,20)(H,17,21)(H,18,22)
InChIKeyWZMHGSKCTBFYFJ-UHFFFAOYSA-N
XLogP-0.25
TPSA116.40 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 5-0.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(hydrazinecarbonyl)propyl]-2,2-dimethylpropanamide
CID 43132144
N-butyl-4-(2,2-dimethylhydrazinyl)-4-oxobutanamide
CID 2232760
4-N'-ethyl-4-N-propanoylbutanedihydrazide
CID 18967872
4-N-ethylbutanedihydrazide
CID 20213809
4-hydrazinyl-N-[2-[2-[(4-hydrazinyl-4-oxobutanoyl)amino]ethyldisulfanyl]ethyl]-4-oxobutanamide
CID 25104329
N-(4-hydrazinyl-4-oxobutyl)-3-[[3-[(4-hydrazinyl-4-oxobutyl)amino]-3-oxopropyl]disulfanyl]propanamide
CID 25104448
N-(6-Hydrazino-6-oxohexyl)acetamide
CID 43236675
N'-acetyl-N-propylbutanehydrazide
CID 54297317
N'-acetyl-N-ethylbutanehydrazide
CID 54397408
N-[3-[2-(3-acetamidopropanoyl)hydrazinyl]-3-oxopropyl]butanamide
CID 56609020
N-[2-[2-(2-acetamidoacetyl)hydrazinyl]-2-oxoethyl]butanamide
CID 56982020
N-[5-[2-(5-acetamidopentyl)hydrazinyl]pentyl]butanamide
CID 57022282

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide?
The IUPAC name of N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide (CID 56606505) is N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide.
What is the SMILES notation for N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide?
The canonical SMILES for N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide is CCCC(=O)NCCCC(=O)NNC(=O)CCCNC(C)=O.
What is the InChIKey of N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide?
The InChIKey is WZMHGSKCTBFYFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O4/c1-3-6-12(20)16-10-5-8-14(22)18-17-13(21)7-4-9-15-11(2)19/h3-10H2,1-2H3,(H,15,19)(H,16,20)(H,17,21)(H,18,22).
What are the key properties of N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide?
N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide has a molecular weight of 314.39 g/mol, XLogP of -0.25, 10 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-acetamidobutanoyl)hydrazinyl]-4-oxobutyl]butanamide is sourced from PubChem (CID 56606505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).