(2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine

C10H17N3 — CID 96743407

IUPAC(2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine
SMILESCc1ccc([C@@H](CN)C(C)C)nn1
InChIInChI=1S/C10H17N3/c1-7(2)9(6-11)10-5-4-8(3)12-13-10/h4-5,7,9H,6,11H2,1-3H3/t9-/m0/s1
InChIKeyWTSYSGALIOGGMY-VIFPVBQESA-N
MW179.27 g/mol
LogP1.48
Rot. Bonds3

About (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine

(2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine (PubChem CID 96743407) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine.

Molecular Properties

Compound Name(2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine
PubChem CID96743407
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name(2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine
SMILESCc1ccc([C@@H](CN)C(C)C)nn1
InChIInChI=1S/C10H17N3/c1-7(2)9(6-11)10-5-4-8(3)12-13-10/h4-5,7,9H,6,11H2,1-3H3/t9-/m0/s1
InChIKeyWTSYSGALIOGGMY-VIFPVBQESA-N
XLogP1.48
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine?
The IUPAC name of (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine (CID 96743407) is (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine.
What is the SMILES notation for (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine?
The canonical SMILES for (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine is Cc1ccc([C@@H](CN)C(C)C)nn1.
What is the InChIKey of (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine?
The InChIKey is WTSYSGALIOGGMY-VIFPVBQESA-N. The full InChI is InChI=1S/C10H17N3/c1-7(2)9(6-11)10-5-4-8(3)12-13-10/h4-5,7,9H,6,11H2,1-3H3/t9-/m0/s1.
What are the key properties of (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine?
(2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-methyl-2-(6-methylpyridazin-3-yl)butan-1-amine is sourced from PubChem (CID 96743407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).