1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine

C16H27N3 — CID 105153848

IUPAC1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine
SMILESCCc1nnc(C)cc1C(NC)C1CCC(C)CC1
InChIInChI=1S/C16H27N3/c1-5-15-14(10-12(3)18-19-15)16(17-4)13-8-6-11(2)7-9-13/h10-11,13,16-17H,5-9H2,1-4H3
InChIKeyWLSVLOVOHPVBLB-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.43
Rot. Bonds4

About 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine

1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine (PubChem CID 105153848) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine.

Molecular Properties

Compound Name1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine
PubChem CID105153848
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine
SMILESCCc1nnc(C)cc1C(NC)C1CCC(C)CC1
InChIInChI=1S/C16H27N3/c1-5-15-14(10-12(3)18-19-15)16(17-4)13-8-6-11(2)7-9-13/h10-11,13,16-17H,5-9H2,1-4H3
InChIKeyWLSVLOVOHPVBLB-UHFFFAOYSA-N
XLogP3.43
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(oxan-3-yl)methanamine
CID 107139182
N-[cyclohexyl-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 105079704
(3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol
CID 105102866
1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-2-(oxan-4-yl)ethanamine
CID 105138796
cycloheptyl-(3-ethyl-6-methylpyridazin-4-yl)methanamine
CID 105176345
2-cyclopropyl-1-(3-ethyl-6-methylpyridazin-4-yl)ethanamine
CID 105152857
N-[(2-ethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 105151189
N-[(3-ethyl-6-methylpyridazin-4-yl)-(oxan-3-yl)methyl]ethanamine
CID 107139181
N-[2-cyclobutyl-1-(3-ethyl-6-methylpyridazin-4-yl)ethyl]propan-1-amine
CID 105151585
N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
CID 105157145
1-(2-fluoro-5-methylphenyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
CID 63415562
N-[(3,6-dimethylpyridazin-4-yl)-(4-ethylcyclohexyl)methyl]propan-1-amine
CID 105155357

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine?
The IUPAC name of 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine (CID 105153848) is 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine.
What is the SMILES notation for 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine?
The canonical SMILES for 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine is CCc1nnc(C)cc1C(NC)C1CCC(C)CC1.
What is the InChIKey of 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine?
The InChIKey is WLSVLOVOHPVBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-5-15-14(10-12(3)18-19-15)16(17-4)13-8-6-11(2)7-9-13/h10-11,13,16-17H,5-9H2,1-4H3.
What are the key properties of 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine?
1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine has a molecular weight of 261.41 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine is sourced from PubChem (CID 105153848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).