N'-undecylpyridine-4-carbohydrazide

C17H29N3O — CID 27387

IUPACN'-undecylpyridine-4-carbohydrazide
SMILESCCCCCCCCCCCNNC(=O)c1ccncc1
InChIInChI=1S/C17H29N3O/c1-2-3-4-5-6-7-8-9-10-13-19-20-17(21)16-11-14-18-15-12-16/h11-12,14-15,19H,2-10,13H2,1H3,(H,20,21)
InChIKeyASPHVMZAORPPAC-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.85
Rot. Bonds12

About N'-undecylpyridine-4-carbohydrazide

N'-undecylpyridine-4-carbohydrazide (PubChem CID 27387) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is N'-undecylpyridine-4-carbohydrazide.

Molecular Properties

Compound NameN'-undecylpyridine-4-carbohydrazide
PubChem CID27387
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC NameN'-undecylpyridine-4-carbohydrazide
SMILESCCCCCCCCCCCNNC(=O)c1ccncc1
InChIInChI=1S/C17H29N3O/c1-2-3-4-5-6-7-8-9-10-13-19-20-17(21)16-11-14-18-15-12-16/h11-12,14-15,19H,2-10,13H2,1H3,(H,20,21)
InChIKeyASPHVMZAORPPAC-UHFFFAOYSA-N
XLogP3.85
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-hexylpyridine-4-carboxamide
CID 3423732
1-hexyl-3-(pyridine-4-carbonylamino)urea
CID 24975112
1-heptyl-3-(pyridine-4-carbonylamino)urea
CID 86577414
N-pentylpyridine-4-carboxamide
CID 2307296
N'-heptylpyrimidine-5-carbohydrazide
CID 156654791
N'-tetradecanoylpyridine-4-carbohydrazide
CID 54792198
N-propyl-3-[2-(pyridine-4-carbonyl)hydrazinyl]propanamide
CID 27388
N-butylpyridine-4-carboxamide
CID 5030535
N'-butyl-4-methylbenzohydrazide
CID 118418346
N'-butyl-4-tert-butylbenzohydrazide
CID 117094788
N'-[3-(2-methylhydrazinyl)-3-oxopropyl]pyridine-4-carbohydrazide
CID 134098184
N'-[(E)-pent-3-enyl]pyridine-4-carbohydrazide
CID 6474921

Frequently Asked Questions

What is the IUPAC name of N'-undecylpyridine-4-carbohydrazide?
The IUPAC name of N'-undecylpyridine-4-carbohydrazide (CID 27387) is N'-undecylpyridine-4-carbohydrazide.
What is the SMILES notation for N'-undecylpyridine-4-carbohydrazide?
The canonical SMILES for N'-undecylpyridine-4-carbohydrazide is CCCCCCCCCCCNNC(=O)c1ccncc1.
What is the InChIKey of N'-undecylpyridine-4-carbohydrazide?
The InChIKey is ASPHVMZAORPPAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-2-3-4-5-6-7-8-9-10-13-19-20-17(21)16-11-14-18-15-12-16/h11-12,14-15,19H,2-10,13H2,1H3,(H,20,21).
What are the key properties of N'-undecylpyridine-4-carbohydrazide?
N'-undecylpyridine-4-carbohydrazide has a molecular weight of 291.44 g/mol, XLogP of 3.85, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-undecylpyridine-4-carbohydrazide is sourced from PubChem (CID 27387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).