6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide

C12H19N5O2 — CID 112695977

IUPAC6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide
SMILESCC(C)(C)NC(=O)CCNc1ccc(C(N)=O)nn1
InChIInChI=1S/C12H19N5O2/c1-12(2,3)15-10(18)6-7-14-9-5-4-8(11(13)19)16-17-9/h4-5H,6-7H2,1-3H3,(H2,13,19)(H,14,17)(H,15,18)
InChIKeyJJDPGZOPBRFESJ-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.29
Rot. Bonds5

About 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide

6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide (PubChem CID 112695977) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide
PubChem CID112695977
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide
SMILESCC(C)(C)NC(=O)CCNc1ccc(C(N)=O)nn1
InChIInChI=1S/C12H19N5O2/c1-12(2,3)15-10(18)6-7-14-9-5-4-8(11(13)19)16-17-9/h4-5H,6-7H2,1-3H3,(H2,13,19)(H,14,17)(H,15,18)
InChIKeyJJDPGZOPBRFESJ-UHFFFAOYSA-N
XLogP0.29
TPSA110.00 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[[3-(tert-butylamino)-3-oxopropyl]amino]-N-methylpyridazine-3-carboxamide
CID 115669069
methyl 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxylate
CID 115609127
6-(2-acetamidoethylamino)pyridazine-3-carboxamide
CID 79769956
6-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridazine-3-carboxylic acid
CID 115356492
6-(2-ethylsulfinylethylamino)pyridazine-3-carboxamide
CID 115667657
methyl 6-[[3-(methylamino)-3-oxopropyl]amino]pyridazine-3-carboxylate
CID 60968294
6-(3-cyclopropylpropylamino)pyridazine-3-carboxamide
CID 115667673
6-[3-(methanesulfonamido)propylamino]pyridazine-3-carboxamide
CID 113246651
6-(2-pyridin-2-ylethylamino)pyridazine-3-carboxamide
CID 79005951
6-[(3-methyl-2-propan-2-ylbutyl)amino]pyridazine-3-carboxamide
CID 102913837
6-(hex-5-ynylamino)pyridazine-3-carboxamide
CID 103757420
5-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridine-2-carboxylic acid
CID 113435949

Frequently Asked Questions

What is the IUPAC name of 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide?
The IUPAC name of 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide (CID 112695977) is 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide?
The canonical SMILES for 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide is CC(C)(C)NC(=O)CCNc1ccc(C(N)=O)nn1.
What is the InChIKey of 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide?
The InChIKey is JJDPGZOPBRFESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-12(2,3)15-10(18)6-7-14-9-5-4-8(11(13)19)16-17-9/h4-5H,6-7H2,1-3H3,(H2,13,19)(H,14,17)(H,15,18).
What are the key properties of 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide?
6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide has a molecular weight of 265.32 g/mol, XLogP of 0.29, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxamide is sourced from PubChem (CID 112695977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).