(6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone

C14H22N4O — CID 55042129

IUPAC(6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone
SMILESCC(C)(C)C1CCN(C(=O)c2ccc(N)nn2)CC1
InChIInChI=1S/C14H22N4O/c1-14(2,3)10-6-8-18(9-7-10)13(19)11-4-5-12(15)17-16-11/h4-5,10H,6-9H2,1-3H3,(H2,15,17)
InChIKeySJLYXEBUDAHEAR-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.96
Rot. Bonds1

About (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone

(6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone (PubChem CID 55042129) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone
PubChem CID55042129
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name(6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone
SMILESCC(C)(C)C1CCN(C(=O)c2ccc(N)nn2)CC1
InChIInChI=1S/C14H22N4O/c1-14(2,3)10-6-8-18(9-7-10)13(19)11-4-5-12(15)17-16-11/h4-5,10H,6-9H2,1-3H3,(H2,15,17)
InChIKeySJLYXEBUDAHEAR-UHFFFAOYSA-N
XLogP1.96
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone 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-aminopyridazin-3-yl)-(4-tert-butylpiperazin-1-yl)methanone
CID 62186658
(6-amino-2-pyridinyl)-(3-tert-butylpyrrolidin-1-yl)methanone
CID 113418713
(6-aminopyridazin-3-yl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 55158606
(6-aminopyridazin-3-yl)-(3-pyrrolidin-1-ylpyrrolidin-1-yl)methanone
CID 63175300
(2-amino-3-pyridinyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 62160129
(3-amino-2-pyridinyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 104742169
(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
CID 62237509
(3-amino-4-methylphenyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 62091781
(2-amino-3-methylphenyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 62091780
2-(4-tert-butylazepane-1-carbonyl)pyridine-4-carboxylic acid
CID 122055710
(4-tert-butylazepan-1-yl)-(1-methylimidazol-4-yl)methanone
CID 118771341
(2-amino-4,5-difluorophenyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 62091602

Frequently Asked Questions

What is the IUPAC name of (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone?
The IUPAC name of (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone (CID 55042129) is (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone.
What is the SMILES notation for (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone?
The canonical SMILES for (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone is CC(C)(C)C1CCN(C(=O)c2ccc(N)nn2)CC1.
What is the InChIKey of (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone?
The InChIKey is SJLYXEBUDAHEAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-14(2,3)10-6-8-18(9-7-10)13(19)11-4-5-12(15)17-16-11/h4-5,10H,6-9H2,1-3H3,(H2,15,17).
What are the key properties of (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone?
(6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone has a molecular weight of 262.36 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone is sourced from PubChem (CID 55042129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).