N-(4-aminocyclohexyl)pyridazine-4-carboxamide

C11H16N4O — CID 104670019

IUPACN-(4-aminocyclohexyl)pyridazine-4-carboxamide
SMILESNC1CCC(NC(=O)c2ccnnc2)CC1
InChIInChI=1S/C11H16N4O/c12-9-1-3-10(4-2-9)15-11(16)8-5-6-13-14-7-8/h5-7,9-10H,1-4,12H2,(H,15,16)
InChIKeyQWEBRPXVLAKBEJ-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.48
Rot. Bonds2

About N-(4-aminocyclohexyl)pyridazine-4-carboxamide

N-(4-aminocyclohexyl)pyridazine-4-carboxamide (PubChem CID 104670019) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)pyridazine-4-carboxamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)pyridazine-4-carboxamide
PubChem CID104670019
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC NameN-(4-aminocyclohexyl)pyridazine-4-carboxamide
SMILESNC1CCC(NC(=O)c2ccnnc2)CC1
InChIInChI=1S/C11H16N4O/c12-9-1-3-10(4-2-9)15-11(16)8-5-6-13-14-7-8/h5-7,9-10H,1-4,12H2,(H,15,16)
InChIKeyQWEBRPXVLAKBEJ-UHFFFAOYSA-N
XLogP0.48
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexylpyridazine-4-carboxamide
CID 112701044
N-[1-(2-amino-2-sulfanylideneethyl)piperidin-4-yl]pyridazine-4-carboxamide
CID 104670473
4-N-(4-aminocyclohexyl)benzene-1,4-dicarboxamide;hydrochloride
CID 119478160
N-(1-ethylsulfonylpiperidin-4-yl)pyridazine-4-carboxamide
CID 127667132
N-(4-aminocyclohexyl)-4-chlorobenzamide;hydrochloride
CID 86277368
N-[(1R,2R)-2-hydroxycyclohexyl]pyridazine-4-carboxamide
CID 104927784
N-(4-aminocyclohexyl)-4-(bromomethyl)benzamide
CID 102851590
N-(4-aminocyclohexyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 119476017
N-(4-aminocyclohexyl)-3-fluoropyridine-4-carboxamide
CID 64950869
pyridazine-4-carbohydrazide;hydrochloride
CID 122236542
N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)pyridazine-4-carboxamide
CID 91922610
N-(4-aminocyclohexyl)-3-hydroxy-4-methylbenzamide
CID 43653129

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)pyridazine-4-carboxamide?
The IUPAC name of N-(4-aminocyclohexyl)pyridazine-4-carboxamide (CID 104670019) is N-(4-aminocyclohexyl)pyridazine-4-carboxamide.
What is the SMILES notation for N-(4-aminocyclohexyl)pyridazine-4-carboxamide?
The canonical SMILES for N-(4-aminocyclohexyl)pyridazine-4-carboxamide is NC1CCC(NC(=O)c2ccnnc2)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)pyridazine-4-carboxamide?
The InChIKey is QWEBRPXVLAKBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c12-9-1-3-10(4-2-9)15-11(16)8-5-6-13-14-7-8/h5-7,9-10H,1-4,12H2,(H,15,16).
What are the key properties of N-(4-aminocyclohexyl)pyridazine-4-carboxamide?
N-(4-aminocyclohexyl)pyridazine-4-carboxamide has a molecular weight of 220.28 g/mol, XLogP of 0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)pyridazine-4-carboxamide is sourced from PubChem (CID 104670019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).