6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide

C12H18N4O — CID 113256808

IUPAC6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide
SMILESCCCC1(CNc2ccc(C(N)=O)nn2)CC1
InChIInChI=1S/C12H18N4O/c1-2-5-12(6-7-12)8-14-10-4-3-9(11(13)17)15-16-10/h3-4H,2,5-8H2,1H3,(H2,13,17)(H,14,16)
InChIKeyRALBIEDLLMWLQP-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.57
Rot. Bonds6

About 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide

6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide (PubChem CID 113256808) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide
PubChem CID113256808
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide
SMILESCCCC1(CNc2ccc(C(N)=O)nn2)CC1
InChIInChI=1S/C12H18N4O/c1-2-5-12(6-7-12)8-14-10-4-3-9(11(13)17)15-16-10/h3-4H,2,5-8H2,1H3,(H2,13,17)(H,14,16)
InChIKeyRALBIEDLLMWLQP-UHFFFAOYSA-N
XLogP1.57
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide
CID 103761722
6-[(1-ethylcyclobutyl)methylamino]pyridazine-3-carboxamide
CID 103741792
6-[(1-methylcyclopropyl)methylamino]pyridazine-3-carboxamide
CID 103724970
6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridazine-3-carboxamide
CID 113295252
methyl 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyridazine-3-carboxylate
CID 114749606
6-[(1-aminocyclobutyl)methylamino]pyridazine-3-carboxamide
CID 103354254
1-[[(6-carbamoylpyridazin-3-yl)amino]methyl]cycloheptane-1-carboxylic acid
CID 115443595
6-[(2-ethylsulfanyl-1-hydroxycyclobutyl)methylamino]pyridazine-3-carboxamide
CID 133357901
6-[(1-hydroxy-3-methylcyclohexyl)methylamino]pyridazine-3-carboxamide
CID 79098492
N-ethyl-6-[(1-ethylcyclopentyl)methylamino]pyridazine-3-carboxamide
CID 103764956
6-chloro-3-[(1-propylcyclopropyl)methylamino]pyridazine-4-carboxamide
CID 133380543
6-[[1-(2-aminoethyl)cyclopropyl]methylamino]pyridine-3-carboxamide
CID 114759134

Frequently Asked Questions

What is the IUPAC name of 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide?
The IUPAC name of 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide (CID 113256808) is 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide?
The canonical SMILES for 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide is CCCC1(CNc2ccc(C(N)=O)nn2)CC1.
What is the InChIKey of 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide?
The InChIKey is RALBIEDLLMWLQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-2-5-12(6-7-12)8-14-10-4-3-9(11(13)17)15-16-10/h3-4H,2,5-8H2,1H3,(H2,13,17)(H,14,16).
What are the key properties of 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide?
6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 1.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 113256808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).