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

C14H21N5O — CID 107488769

IUPACN-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide
SMILESCCNC(=O)c1ccc(NCCC2=CCNCC2)nn1
InChIInChI=1S/C14H21N5O/c1-2-16-14(20)12-3-4-13(19-18-12)17-10-7-11-5-8-15-9-6-11/h3-5,15H,2,6-10H2,1H3,(H,16,20)(H,17,19)
InChIKeyIDZPRVAZRWXLCT-UHFFFAOYSA-N
MW275.36 g/mol
LogP0.95
Rot. Bonds6

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

N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide (PubChem CID 107488769) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide
PubChem CID107488769
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide
SMILESCCNC(=O)c1ccc(NCCC2=CCNCC2)nn1
InChIInChI=1S/C14H21N5O/c1-2-16-14(20)12-3-4-13(19-18-12)17-10-7-11-5-8-15-9-6-11/h3-5,15H,2,6-10H2,1H3,(H,16,20)(H,17,19)
InChIKeyIDZPRVAZRWXLCT-UHFFFAOYSA-N
XLogP0.95
TPSA78.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-6-[2-(1-methylpyrazol-4-yl)ethylamino]pyridazine-3-carboxamide
CID 80688877
6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridine-2-carboxamide
CID 107489464
N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
N-ethyl-6-[[3-oxo-3-(propan-2-ylamino)propyl]amino]pyridazine-3-carboxamide
CID 115690617
5-chloro-N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]pyridine-2-carboxamide
CID 107487182
N-ethyl-6-[(4-ethylphenyl)methylamino]pyridazine-3-carboxamide
CID 106898486
6-[2-(cyclohexen-1-yl)ethylamino]-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
CID 109113542
6-[2-(cyclohexen-1-yl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]pyridazine-3-carboxamide
CID 109113526
N-ethyl-6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide
CID 103761722
N-ethyl-6-(3-pyrazol-1-ylpropylamino)pyridazine-3-carboxamide
CID 115690608
6-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridazine-3-carboxamide
CID 55047399
2-ethyl-2-[[[6-(ethylcarbamoyl)pyridazin-3-yl]amino]methyl]butanoic acid
CID 115430062

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide?
The IUPAC name of N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide (CID 107488769) is N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide?
The canonical SMILES for N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide is CCNC(=O)c1ccc(NCCC2=CCNCC2)nn1.
What is the InChIKey of N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide?
The InChIKey is IDZPRVAZRWXLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-2-16-14(20)12-3-4-13(19-18-12)17-10-7-11-5-8-15-9-6-11/h3-5,15H,2,6-10H2,1H3,(H,16,20)(H,17,19).
What are the key properties of N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide?
N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide has a molecular weight of 275.36 g/mol, XLogP of 0.95, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 107488769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).