6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine

C17H30N4 — CID 62289252

IUPAC6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine
SMILESCN(CC1CCCCC1)c1ccc(CNC(C)(C)C)nn1
InChIInChI=1S/C17H30N4/c1-17(2,3)18-12-15-10-11-16(20-19-15)21(4)13-14-8-6-5-7-9-14/h10-11,14,18H,5-9,12-13H2,1-4H3
InChIKeyFZOGVYKHQDIYNT-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.38
Rot. Bonds5

About 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine

6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine (PubChem CID 62289252) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine
PubChem CID62289252
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC Name6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine
SMILESCN(CC1CCCCC1)c1ccc(CNC(C)(C)C)nn1
InChIInChI=1S/C17H30N4/c1-17(2,3)18-12-15-10-11-16(20-19-15)21(4)13-14-8-6-5-7-9-14/h10-11,14,18H,5-9,12-13H2,1-4H3
InChIKeyFZOGVYKHQDIYNT-UHFFFAOYSA-N
XLogP3.38
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine?
The IUPAC name of 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine (CID 62289252) is 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine.
What is the SMILES notation for 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine?
The canonical SMILES for 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine is CN(CC1CCCCC1)c1ccc(CNC(C)(C)C)nn1.
What is the InChIKey of 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine?
The InChIKey is FZOGVYKHQDIYNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-17(2,3)18-12-15-10-11-16(20-19-15)21(4)13-14-8-6-5-7-9-14/h10-11,14,18H,5-9,12-13H2,1-4H3.
What are the key properties of 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine?
6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine has a molecular weight of 290.45 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-N-methylpyridazin-3-amine is sourced from PubChem (CID 62289252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).