6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide

C15H26N4O — CID 106027867

IUPAC6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide
SMILESCCCCC(CCC)NC(=O)c1ccc(NCC)nn1
InChIInChI=1S/C15H26N4O/c1-4-7-9-12(8-5-2)17-15(20)13-10-11-14(16-6-3)19-18-13/h10-12H,4-9H2,1-3H3,(H,16,19)(H,17,20)
InChIKeyNZISAEAXVHNHPB-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.00
Rot. Bonds9

About 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide

6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide (PubChem CID 106027867) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide
PubChem CID106027867
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide
SMILESCCCCC(CCC)NC(=O)c1ccc(NCC)nn1
InChIInChI=1S/C15H26N4O/c1-4-7-9-12(8-5-2)17-15(20)13-10-11-14(16-6-3)19-18-13/h10-12H,4-9H2,1-3H3,(H,16,19)(H,17,20)
InChIKeyNZISAEAXVHNHPB-UHFFFAOYSA-N
XLogP3.00
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-octan-4-yl-6-(propylamino)pyridazine-3-carboxamide
CID 106027845
6-(ethylamino)-N-hexan-3-ylpyridazine-3-carboxamide
CID 62181112
6-(butylamino)-N-propan-2-ylpyridazine-3-carboxamide
CID 109109597
N-pentan-2-yl-6-(propylamino)pyridazine-3-carboxamide
CID 62185105
N-octan-4-yl-6-(propylamino)pyridine-2-carboxamide
CID 106027806
6-(ethylamino)-N-(1-pyridin-4-ylethyl)pyridazine-3-carboxamide
CID 62168833
6-(ethylamino)-N-(1-phenylpropyl)pyridazine-3-carboxamide
CID 62303897
5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
CID 106027811
6-(1-aminohexan-2-ylamino)-N-methylpyridazine-3-carboxamide
CID 80697257
N,N-dibutyl-6-(ethylamino)pyridazine-3-carboxamide
CID 62167195
6-(ethylamino)-N-[1-(2H-tetrazol-5-yl)ethyl]pyridazine-3-carboxamide
CID 62174936
5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide
CID 106025870

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide (CID 106027867) is 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide is CCCCC(CCC)NC(=O)c1ccc(NCC)nn1.
What is the InChIKey of 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide?
The InChIKey is NZISAEAXVHNHPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-7-9-12(8-5-2)17-15(20)13-10-11-14(16-6-3)19-18-13/h10-12H,4-9H2,1-3H3,(H,16,19)(H,17,20).
What are the key properties of 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide?
6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 3.00, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide is sourced from PubChem (CID 106027867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).