N-pentylpyridazine-3-carboxamide;hydrochloride

C10H16ClN3O — CID 143205726

IUPACN-pentylpyridazine-3-carboxamide;hydrochloride
SMILESCCCCCNC(=O)c1cccnn1.Cl
InChIInChI=1S/C10H15N3O.ClH/c1-2-3-4-7-11-10(14)9-6-5-8-12-13-9;/h5-6,8H,2-4,7H2,1H3,(H,11,14);1H
InChIKeyHYCRPOIZTWBGMV-UHFFFAOYSA-N
MW229.71 g/mol
LogP1.82
Rot. Bonds5

About N-pentylpyridazine-3-carboxamide;hydrochloride

N-pentylpyridazine-3-carboxamide;hydrochloride (PubChem CID 143205726) has the molecular formula C10H16ClN3O and a molecular weight of 229.71 g/mol. Its IUPAC name is N-pentylpyridazine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-pentylpyridazine-3-carboxamide;hydrochloride
PubChem CID143205726
Molecular FormulaC10H16ClN3O
Molecular Weight229.71 g/mol
Exact Mass229.10
IUPAC NameN-pentylpyridazine-3-carboxamide;hydrochloride
SMILESCCCCCNC(=O)c1cccnn1.Cl
InChIInChI=1S/C10H15N3O.ClH/c1-2-3-4-7-11-10(14)9-6-5-8-12-13-9;/h5-6,8H,2-4,7H2,1H3,(H,11,14);1H
InChIKeyHYCRPOIZTWBGMV-UHFFFAOYSA-N
XLogP1.82
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-propylpyridazine-3-carboxamide
CID 89418818
2-N,6-N-didecylpyridine-2,6-dicarboxamide
CID 4564479
N-(3-phenylpropyl)pyridazine-3-carboxamide
CID 152622333
N-(2-cyclopropylethyl)pyridazine-3-carboxamide;hydrochloride
CID 141153348
N-(2-phenylethyl)pyridazine-3-carboxamide
CID 5299221
6-fluoro-N-pentylpyridine-2-carboxamide
CID 115496637
2-N-pentyl-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109099433
2-(pentylcarbamoyl)pyridine-3-carboxylic acid
CID 63614748
3-bromo-N-pentylpyridine-2-carboxamide
CID 107517688
N-octadecylpyridine-3-carboxamide
CID 3547337
N-[6-(pyridine-2-carbonylamino)hexyl]pyridine-2-carboxamide;hydrochloride
CID 54601367
N-pentylpyridine-4-carboxamide
CID 2307296

Frequently Asked Questions

What is the IUPAC name of N-pentylpyridazine-3-carboxamide;hydrochloride?
The IUPAC name of N-pentylpyridazine-3-carboxamide;hydrochloride (CID 143205726) is N-pentylpyridazine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-pentylpyridazine-3-carboxamide;hydrochloride?
The canonical SMILES for N-pentylpyridazine-3-carboxamide;hydrochloride is CCCCCNC(=O)c1cccnn1.Cl.
What is the InChIKey of N-pentylpyridazine-3-carboxamide;hydrochloride?
The InChIKey is HYCRPOIZTWBGMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O.ClH/c1-2-3-4-7-11-10(14)9-6-5-8-12-13-9;/h5-6,8H,2-4,7H2,1H3,(H,11,14);1H.
What are the key properties of N-pentylpyridazine-3-carboxamide;hydrochloride?
N-pentylpyridazine-3-carboxamide;hydrochloride has a molecular weight of 229.71 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentylpyridazine-3-carboxamide;hydrochloride is sourced from PubChem (CID 143205726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).