N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide

C15H24N4O — CID 104668822

IUPACN,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide
SMILESCNC1CCC(N(C)C(=O)c2cc(C)nnc2C)CC1
InChIInChI=1S/C15H24N4O/c1-10-9-14(11(2)18-17-10)15(20)19(4)13-7-5-12(16-3)6-8-13/h9,12-13,16H,5-8H2,1-4H3
InChIKeyKZXNFYVBNHCKSY-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.70
Rot. Bonds3

About N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide

N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide (PubChem CID 104668822) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide.

Molecular Properties

Compound NameN,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide
PubChem CID104668822
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide
SMILESCNC1CCC(N(C)C(=O)c2cc(C)nnc2C)CC1
InChIInChI=1S/C15H24N4O/c1-10-9-14(11(2)18-17-10)15(20)19(4)13-7-5-12(16-3)6-8-13/h9,12-13,16H,5-8H2,1-4H3
InChIKeyKZXNFYVBNHCKSY-UHFFFAOYSA-N
XLogP1.70
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide?
The IUPAC name of N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide (CID 104668822) is N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide.
What is the SMILES notation for N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide?
The canonical SMILES for N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide is CNC1CCC(N(C)C(=O)c2cc(C)nnc2C)CC1.
What is the InChIKey of N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide?
The InChIKey is KZXNFYVBNHCKSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-10-9-14(11(2)18-17-10)15(20)19(4)13-7-5-12(16-3)6-8-13/h9,12-13,16H,5-8H2,1-4H3.
What are the key properties of N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide?
N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,6-trimethyl-N-[4-(methylamino)cyclohexyl]pyridazine-4-carboxamide is sourced from PubChem (CID 104668822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).