N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine

C20H22N4S — CID 108775388

IUPACN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine
SMILESCc1nc(C(C)Nc2ccc(-c3ccc4c(c3)CCCC4)nn2)cs1
InChIInChI=1S/C20H22N4S/c1-13(19-12-25-14(2)22-19)21-20-10-9-18(23-24-20)17-8-7-15-5-3-4-6-16(15)11-17/h7-13H,3-6H2,1-2H3,(H,21,24)
InChIKeySZJBOQZNQPEQFH-UHFFFAOYSA-N
MW350.49 g/mol
LogP4.96
Rot. Bonds4

About N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine

N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine (PubChem CID 108775388) has the molecular formula C20H22N4S and a molecular weight of 350.49 g/mol. Its IUPAC name is N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine
PubChem CID108775388
Molecular FormulaC20H22N4S
Molecular Weight350.49 g/mol
Exact Mass350.16
IUPAC NameN-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine
SMILESCc1nc(C(C)Nc2ccc(-c3ccc4c(c3)CCCC4)nn2)cs1
InChIInChI=1S/C20H22N4S/c1-13(19-12-25-14(2)22-19)21-20-10-9-18(23-24-20)17-8-7-15-5-3-4-6-16(15)11-17/h7-13H,3-6H2,1-2H3,(H,21,24)
InChIKeySZJBOQZNQPEQFH-UHFFFAOYSA-N
XLogP4.96
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.49
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,3-dihydro-1H-inden-5-amine
CID 43670073
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-phenylaniline
CID 43716894
3,4-dichloro-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]aniline
CID 43670072
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophen-3-amine
CID 66351418
4-(2,3-dihydro-1H-inden-5-yl)-N-[(2R)-1-methoxypropan-2-yl]-1,3-thiazol-2-amine
CID 8878542
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]naphthalen-2-amine
CID 43680346
2-methyl-4-(1,2,3,4-tetrahydroquinolin-6-yl)-1,3-thiazole
CID 20983466
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-propylaniline
CID 43670202
(2S)-2-acetamido-N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]propanamide
CID 95306112
2-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-5-(1,3,4-oxadiazol-2-yl)aniline
CID 43701911
diethyl 2-methyl-5-[[6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-yl]amino]furan-3,4-dicarboxylate
CID 108776192
4-(2-methyl-1,3-thiazol-4-yl)-N-propan-2-ylaniline
CID 28682074

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine?
The IUPAC name of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine (CID 108775388) is N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine.
What is the SMILES notation for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine?
The canonical SMILES for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine is Cc1nc(C(C)Nc2ccc(-c3ccc4c(c3)CCCC4)nn2)cs1.
What is the InChIKey of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine?
The InChIKey is SZJBOQZNQPEQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4S/c1-13(19-12-25-14(2)22-19)21-20-10-9-18(23-24-20)17-8-7-15-5-3-4-6-16(15)11-17/h7-13H,3-6H2,1-2H3,(H,21,24).
What are the key properties of N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine?
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine has a molecular weight of 350.49 g/mol, XLogP of 4.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridazin-3-amine is sourced from PubChem (CID 108775388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).