6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide

C14H23N5O — CID 62178776

IUPAC6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCC2CCN(C)CC2)nn1
InChIInChI=1S/C14H23N5O/c1-3-15-13-5-4-12(17-18-13)14(20)16-10-11-6-8-19(2)9-7-11/h4-5,11H,3,6-10H2,1-2H3,(H,15,18)(H,16,20)
InChIKeyCWRINBKBSLLEFB-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.98
Rot. Bonds5

About 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide

6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide (PubChem CID 62178776) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide
PubChem CID62178776
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCC2CCN(C)CC2)nn1
InChIInChI=1S/C14H23N5O/c1-3-15-13-5-4-12(17-18-13)14(20)16-10-11-6-8-19(2)9-7-11/h4-5,11H,3,6-10H2,1-2H3,(H,15,18)(H,16,20)
InChIKeyCWRINBKBSLLEFB-UHFFFAOYSA-N
XLogP0.98
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide
CID 62181516
N-[(1-ethylpyrrolidin-3-yl)methyl]-6-hydrazinylpyridazine-3-carboxamide
CID 62237446
5-amino-N-[(1-methylpiperidin-4-yl)methyl]pyridine-2-carboxamide
CID 81316570
N-[2-[cyclopropyl(methyl)amino]ethyl]-6-(ethylamino)pyridazine-3-carboxamide
CID 55142201
[6-(ethylamino)pyridazin-3-yl]-[3-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 64581169
6-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridazine-3-carboxamide
CID 55047399
N-cycloheptyl-6-(ethylamino)pyridazine-3-carboxamide
CID 55042572
6-(ethylamino)-N-(2-propan-2-yloxyethyl)pyridazine-3-carboxamide
CID 113450833
6-(ethylamino)-N-(4-hydroxycyclohexyl)pyridazine-3-carboxamide
CID 55042745
6-(ethylamino)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridazine-3-carboxamide
CID 62180418
6-(ethylamino)-N-[(1-methylpyrazol-3-yl)methyl]pyridazine-3-carboxamide
CID 82875427
N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine
CID 116973215

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide (CID 62178776) is 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide is CCNc1ccc(C(=O)NCC2CCN(C)CC2)nn1.
What is the InChIKey of 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide?
The InChIKey is CWRINBKBSLLEFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-3-15-13-5-4-12(17-18-13)14(20)16-10-11-6-8-19(2)9-7-11/h4-5,11H,3,6-10H2,1-2H3,(H,15,18)(H,16,20).
What are the key properties of 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide?
6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-[(1-methylpiperidin-4-yl)methyl]pyridazine-3-carboxamide is sourced from PubChem (CID 62178776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).