N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine

C10H17N3 — CID 63202272

IUPACN,3-dimethyl-1-pyridazin-3-ylbutan-2-amine
SMILESCNC(Cc1cccnn1)C(C)C
InChIInChI=1S/C10H17N3/c1-8(2)10(11-3)7-9-5-4-6-12-13-9/h4-6,8,10-11H,7H2,1-3H3
InChIKeyOFXLVJPSOZHHIJ-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.26
Rot. Bonds4

About N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine

N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine (PubChem CID 63202272) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine.

Molecular Properties

Compound NameN,3-dimethyl-1-pyridazin-3-ylbutan-2-amine
PubChem CID63202272
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN,3-dimethyl-1-pyridazin-3-ylbutan-2-amine
SMILESCNC(Cc1cccnn1)C(C)C
InChIInChI=1S/C10H17N3/c1-8(2)10(11-3)7-9-5-4-6-12-13-9/h4-6,8,10-11H,7H2,1-3H3
InChIKeyOFXLVJPSOZHHIJ-UHFFFAOYSA-N
XLogP1.26
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyridazin-3-ylpropan-2-ol
CID 21265829
N-propyl-1-pyridazin-3-ylpropan-2-amine
CID 63200569
3-(2,2-dimethoxyethyl)pyridazine
CID 175308246
1-(6-methoxy-2-pyridinyl)-N,3-dimethylbutan-2-amine
CID 63588562
N,3-dimethyl-1-(4-methyl-2-pyridinyl)butan-2-amine
CID 63201754
N,3-dimethyl-1-(5-methylpyrimidin-2-yl)butan-2-amine
CID 63205925
N,3-dimethyl-1-(1-methylpyrazol-3-yl)butan-2-amine
CID 82877634
ethane;3-[(4-methylphenyl)methyl]pyridazine
CID 143919339
N,3-dimethyl-1-(4-pyridin-3-ylphenyl)butan-2-amine
CID 82540634
N,3-dimethyl-1-[4-(trifluoromethyl)-2-pyridinyl]butan-2-amine
CID 66330877
4-[1-(pyridazin-3-ylmethylamino)ethyl]phenol
CID 106895349
2-methoxy-N-(pyridazin-3-ylmethyl)propan-1-amine
CID 106895779

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine?
The IUPAC name of N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine (CID 63202272) is N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine.
What is the SMILES notation for N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine?
The canonical SMILES for N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine is CNC(Cc1cccnn1)C(C)C.
What is the InChIKey of N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine?
The InChIKey is OFXLVJPSOZHHIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8(2)10(11-3)7-9-5-4-6-12-13-9/h4-6,8,10-11H,7H2,1-3H3.
What are the key properties of N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine?
N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine has a molecular weight of 179.27 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-1-pyridazin-3-ylbutan-2-amine is sourced from PubChem (CID 63202272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).