N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide

C15H22N6O — CID 121114224

IUPACN-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccc(-n2ccnc2C)nn1
InChIInChI=1S/C15H22N6O/c1-4-20(5-2)10-8-17-15(22)13-6-7-14(19-18-13)21-11-9-16-12(21)3/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,17,22)
InChIKeyKHKFCMVPWITHIX-UHFFFAOYSA-N
MW302.38 g/mol
LogP1.04
Rot. Bonds7

About N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide

N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide (PubChem CID 121114224) has the molecular formula C15H22N6O and a molecular weight of 302.38 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
PubChem CID121114224
Molecular FormulaC15H22N6O
Molecular Weight302.38 g/mol
Exact Mass302.19
IUPAC NameN-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccc(-n2ccnc2C)nn1
InChIInChI=1S/C15H22N6O/c1-4-20(5-2)10-8-17-15(22)13-6-7-14(19-18-13)21-11-9-16-12(21)3/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,17,22)
InChIKeyKHKFCMVPWITHIX-UHFFFAOYSA-N
XLogP1.04
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-[[4-(cyclopropanecarbonylamino)benzoyl]amino]ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
CID 121114458
6-(2-methylimidazol-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyridazine-3-carboxamide
CID 121114381
N-benzyl-6-(2-methylimidazol-1-yl)-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 121114436
N-[2-(diethylamino)ethyl]-1-(difluoromethyl)pyrazole-3-carboxamide
CID 19264128
1-[4-[6-(2-methylimidazol-1-yl)pyridazine-3-carbonyl]piperazin-1-yl]ethanone
CID 121114370
N-[2-(diethylamino)ethyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide
CID 84577912
6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide
CID 121114385
N-[2-(diethylamino)ethyl]-2-pyrrolidin-1-ylpyridine-4-carboxamide
CID 84574612
N-(5-chloro-2-cyanophenyl)-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
CID 121114365
N-[3-(diethylamino)propyl]-6-(ethylamino)pyridazine-3-carboxamide
CID 62166382
N-[2-(dimethylamino)ethyl]-6-(2-ethylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109115393
N-[2-(diethylamino)ethyl]-1-(4-methylphenyl)triazole-4-carboxamide
CID 86985554

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide (CID 121114224) is N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide is CCN(CC)CCNC(=O)c1ccc(-n2ccnc2C)nn1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide?
The InChIKey is KHKFCMVPWITHIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6O/c1-4-20(5-2)10-8-17-15(22)13-6-7-14(19-18-13)21-11-9-16-12(21)3/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,17,22).
What are the key properties of N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide?
N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 1.04, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 121114224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).