N-(2,5-dioxopyrrol-1-yl)undecanehydrazide

C15H25N3O3 — CID 151877376

IUPACN-(2,5-dioxopyrrol-1-yl)undecanehydrazide
SMILESCCCCCCCCCCC(=O)N(N)N1C(=O)C=CC1=O
InChIInChI=1S/C15H25N3O3/c1-2-3-4-5-6-7-8-9-10-15(21)18(16)17-13(19)11-12-14(17)20/h11-12H,2-10,16H2,1H3
InChIKeySNYTWLJRHMQRJF-UHFFFAOYSA-N
MW295.38 g/mol
LogP2.06
Rot. Bonds10

About N-(2,5-dioxopyrrol-1-yl)undecanehydrazide

N-(2,5-dioxopyrrol-1-yl)undecanehydrazide (PubChem CID 151877376) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-(2,5-dioxopyrrol-1-yl)undecanehydrazide.

Molecular Properties

Compound NameN-(2,5-dioxopyrrol-1-yl)undecanehydrazide
PubChem CID151877376
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC NameN-(2,5-dioxopyrrol-1-yl)undecanehydrazide
SMILESCCCCCCCCCCC(=O)N(N)N1C(=O)C=CC1=O
InChIInChI=1S/C15H25N3O3/c1-2-3-4-5-6-7-8-9-10-15(21)18(16)17-13(19)11-12-14(17)20/h11-12H,2-10,16H2,1H3
InChIKeySNYTWLJRHMQRJF-UHFFFAOYSA-N
XLogP2.06
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(2,5-dioxopyrrol-1-yl)-hexanoylamino]-3-methylbutanoic acid
CID 135125401
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azane;N,N-dimethyltetradecanamide;hydrochloride
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N,N-dimethyldecanamide;N,N-dimethyloctanamide
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CID 141047117
N-[2-[di(hexadecanoyl)amino]ethyl]-N-octadecanoyloctadecanamide
CID 88723391
N-hydroxy-N-methyloctadecanamide
CID 19818891
N,N-dimethyldodecanamide;hydrochloride
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N-(2-chloroacetyl)-N-icosanoylicosanamide
CID 162712848

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dioxopyrrol-1-yl)undecanehydrazide?
The IUPAC name of N-(2,5-dioxopyrrol-1-yl)undecanehydrazide (CID 151877376) is N-(2,5-dioxopyrrol-1-yl)undecanehydrazide.
What is the SMILES notation for N-(2,5-dioxopyrrol-1-yl)undecanehydrazide?
The canonical SMILES for N-(2,5-dioxopyrrol-1-yl)undecanehydrazide is CCCCCCCCCCC(=O)N(N)N1C(=O)C=CC1=O.
What is the InChIKey of N-(2,5-dioxopyrrol-1-yl)undecanehydrazide?
The InChIKey is SNYTWLJRHMQRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-2-3-4-5-6-7-8-9-10-15(21)18(16)17-13(19)11-12-14(17)20/h11-12H,2-10,16H2,1H3.
What are the key properties of N-(2,5-dioxopyrrol-1-yl)undecanehydrazide?
N-(2,5-dioxopyrrol-1-yl)undecanehydrazide has a molecular weight of 295.38 g/mol, XLogP of 2.06, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dioxopyrrol-1-yl)undecanehydrazide is sourced from PubChem (CID 151877376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).