N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine

C16H30N4O — CID 62287757

IUPACN-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine
SMILESCCC(C)N(CCOC)c1ccc(CNC(C)(C)C)nn1
InChIInChI=1S/C16H30N4O/c1-7-13(2)20(10-11-21-6)15-9-8-14(18-19-15)12-17-16(3,4)5/h8-9,13,17H,7,10-12H2,1-6H3
InChIKeyMAQADFONIDFZGY-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.62
Rot. Bonds8

About N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine

N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine (PubChem CID 62287757) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine
PubChem CID62287757
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC NameN-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine
SMILESCCC(C)N(CCOC)c1ccc(CNC(C)(C)C)nn1
InChIInChI=1S/C16H30N4O/c1-7-13(2)20(10-11-21-6)15-9-8-14(18-19-15)12-17-16(3,4)5/h8-9,13,17H,7,10-12H2,1-6H3
InChIKeyMAQADFONIDFZGY-UHFFFAOYSA-N
XLogP2.62
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(tert-butylamino)methyl]-N-ethyl-N-(1-methoxypropan-2-yl)pyridazin-3-amine
CID 62283025
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine
CID 62287618
6-(ethylaminomethyl)-N-(2-methoxyethyl)-N-pentan-3-ylpyridazin-3-amine
CID 62289229
N-(2-methoxyethyl)-N-propan-2-yl-6-[(propan-2-ylamino)methyl]pyridazin-3-amine
CID 82952712
N-(2-methoxyethyl)-N-propan-2-yl-6-(propylaminomethyl)pyridazin-3-amine
CID 82953348
[6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridazin-3-yl]methanol
CID 55005192
N-butan-2-yl-5-(ethylaminomethyl)-N-(2-methoxyethyl)pyridin-2-amine
CID 62289550
2-[(tert-butylamino)methyl]-N-(2-methoxyethyl)-N-propan-2-ylpyridin-4-amine
CID 82952467
6-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-pentan-3-ylpyridazin-3-amine
CID 62289414
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-6-(propylaminomethyl)pyridazin-3-amine
CID 62293320
N-butan-2-yl-N-ethyl-6-[(propan-2-ylamino)methyl]pyridazin-3-amine
CID 55054723
N-butan-2-yl-N-ethyl-6-[(2-methylpropylamino)methyl]pyridazin-3-amine
CID 62278695

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine?
The IUPAC name of N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine (CID 62287757) is N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine.
What is the SMILES notation for N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine?
The canonical SMILES for N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine is CCC(C)N(CCOC)c1ccc(CNC(C)(C)C)nn1.
What is the InChIKey of N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine?
The InChIKey is MAQADFONIDFZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-7-13(2)20(10-11-21-6)15-9-8-14(18-19-15)12-17-16(3,4)5/h8-9,13,17H,7,10-12H2,1-6H3.
What are the key properties of N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine?
N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine has a molecular weight of 294.44 g/mol, XLogP of 2.62, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-6-[(tert-butylamino)methyl]-N-(2-methoxyethyl)pyridazin-3-amine is sourced from PubChem (CID 62287757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).