N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide

C16H27N5O — CID 109115393

IUPACN-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
SMILESCCC1CCCCN1c1ccc(C(=O)NCCN(C)C)nn1
InChIInChI=1S/C16H27N5O/c1-4-13-7-5-6-11-21(13)15-9-8-14(18-19-15)16(22)17-10-12-20(2)3/h8-9,13H,4-7,10-12H2,1-3H3,(H,17,22)
InChIKeyNWIKSZNBGJJKGK-UHFFFAOYSA-N
MW305.43 g/mol
LogP1.54
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide

N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide (PubChem CID 109115393) has the molecular formula C16H27N5O and a molecular weight of 305.43 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
PubChem CID109115393
Molecular FormulaC16H27N5O
Molecular Weight305.43 g/mol
Exact Mass305.22
IUPAC NameN-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
SMILESCCC1CCCCN1c1ccc(C(=O)NCCN(C)C)nn1
InChIInChI=1S/C16H27N5O/c1-4-13-7-5-6-11-21(13)15-9-8-14(18-19-15)16(22)17-10-12-20(2)3/h8-9,13H,4-7,10-12H2,1-3H3,(H,17,22)
InChIKeyNWIKSZNBGJJKGK-UHFFFAOYSA-N
XLogP1.54
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 109111233
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109123335
ethyl 6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxylate
CID 121206169
6-(2-ethylpiperidin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)pyridazine-3-carboxamide
CID 109125855
N-benzyl-6-(2-ethylpiperidin-1-yl)-N-propan-2-ylpyridazine-3-carboxamide
CID 109125114
6-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyridazine-3-carboxamide
CID 109125838
N-benzyl-N-ethyl-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109120599
6-(2-ethylpiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109125825
ethyl 4-[6-[2-(dimethylamino)ethylcarbamoyl]pyridazin-3-yl]piperazine-1-carboxylate
CID 109115372
6-[2-(aminomethyl)azepan-1-yl]pyridazine-3-carboxamide
CID 116640255
[6-[2-(dimethylamino)ethylamino]pyridazin-3-yl]-(2-ethylpiperidin-1-yl)methanone
CID 109115213
5-(2-ethylpiperidin-1-yl)-N-(3-methylbutyl)pyrazine-2-carboxamide
CID 109287769

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide (CID 109115393) is N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide is CCC1CCCCN1c1ccc(C(=O)NCCN(C)C)nn1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide?
The InChIKey is NWIKSZNBGJJKGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O/c1-4-13-7-5-6-11-21(13)15-9-8-14(18-19-15)16(22)17-10-12-20(2)3/h8-9,13H,4-7,10-12H2,1-3H3,(H,17,22).
What are the key properties of N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide?
N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide has a molecular weight of 305.43 g/mol, XLogP of 1.54, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 109115393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).