6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide

C11H15N7O — CID 64523985

IUPAC6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCCc2ncn[nH]2)nn1
InChIInChI=1S/C11H15N7O/c1-2-12-9-4-3-8(16-18-9)11(19)13-6-5-10-14-7-15-17-10/h3-4,7H,2,5-6H2,1H3,(H,12,18)(H,13,19)(H,14,15,17)
InChIKeyVREHBHKOJXLZKW-UHFFFAOYSA-N
MW261.29 g/mol
LogP-0.00
Rot. Bonds6

About 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide

6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide (PubChem CID 64523985) has the molecular formula C11H15N7O and a molecular weight of 261.29 g/mol. Its IUPAC name is 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide
PubChem CID64523985
Molecular FormulaC11H15N7O
Molecular Weight261.29 g/mol
Exact Mass261.13
IUPAC Name6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCCc2ncn[nH]2)nn1
InChIInChI=1S/C11H15N7O/c1-2-12-9-4-3-8(16-18-9)11(19)13-6-5-10-14-7-15-17-10/h3-4,7H,2,5-6H2,1H3,(H,12,18)(H,13,19)(H,14,15,17)
InChIKeyVREHBHKOJXLZKW-UHFFFAOYSA-N
XLogP-0.00
TPSA108.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.29
LogP ≤ 5-0.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

6-hydrazinyl-N-[3-(1H-1,2,4-triazol-5-yl)propyl]pyridazine-3-carboxamide
CID 64524982
6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 62186107
N-methyl-6-(1H-1,2,4-triazol-5-ylmethylamino)pyridazine-3-carboxamide
CID 79208438
2-methyl-6-[2-(1H-1,2,4-triazol-5-yl)ethylcarbamoyl]pyridine-3-carboxylic acid
CID 64523559
5-(methylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-2-carboxamide
CID 104641538
6-(ethylamino)-N-[2-(2-methylphenyl)ethyl]pyridazine-3-carboxamide
CID 79756979
6-(ethylamino)-N-(2-propan-2-yloxyethyl)pyridazine-3-carboxamide
CID 113450833
N-[3-(diethylamino)propyl]-6-(ethylamino)pyridazine-3-carboxamide
CID 62166382
N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
6-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridazine-3-carboxamide
CID 55047399
6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-3-sulfonamide
CID 64524954
2,6-dimethyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]benzamide
CID 103769288

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide (CID 64523985) is 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide is CCNc1ccc(C(=O)NCCc2ncn[nH]2)nn1.
What is the InChIKey of 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide?
The InChIKey is VREHBHKOJXLZKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O/c1-2-12-9-4-3-8(16-18-9)11(19)13-6-5-10-14-7-15-17-10/h3-4,7H,2,5-6H2,1H3,(H,12,18)(H,13,19)(H,14,15,17).
What are the key properties of 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide?
6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide has a molecular weight of 261.29 g/mol, XLogP of -0.00, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide is sourced from PubChem (CID 64523985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).