6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine

C16H23N5O — CID 23275891

IUPAC6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine
SMILESCc1ccc(C)n1Nc1ccc(N2C(C)COCC2C)nn1
InChIInChI=1S/C16H23N5O/c1-11-5-6-12(2)21(11)19-15-7-8-16(18-17-15)20-13(3)9-22-10-14(20)4/h5-8,13-14H,9-10H2,1-4H3,(H,17,19)
InChIKeyMSNFFWKEKVQREE-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.38
Rot. Bonds3

About 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine

6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine (PubChem CID 23275891) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine
PubChem CID23275891
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC Name6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine
SMILESCc1ccc(C)n1Nc1ccc(N2C(C)COCC2C)nn1
InChIInChI=1S/C16H23N5O/c1-11-5-6-12(2)21(11)19-15-7-8-16(18-17-15)20-13(3)9-22-10-14(20)4/h5-8,13-14H,9-10H2,1-4H3,(H,17,19)
InChIKeyMSNFFWKEKVQREE-UHFFFAOYSA-N
XLogP2.38
TPSA55.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine?
The IUPAC name of 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine (CID 23275891) is 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine.
What is the SMILES notation for 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine?
The canonical SMILES for 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine is Cc1ccc(C)n1Nc1ccc(N2C(C)COCC2C)nn1.
What is the InChIKey of 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine?
The InChIKey is MSNFFWKEKVQREE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-11-5-6-12(2)21(11)19-15-7-8-16(18-17-15)20-13(3)9-22-10-14(20)4/h5-8,13-14H,9-10H2,1-4H3,(H,17,19).
What are the key properties of 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine?
6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine has a molecular weight of 301.39 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethylmorpholin-4-yl)-N-(2,5-dimethylpyrrol-1-yl)pyridazin-3-amine is sourced from PubChem (CID 23275891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).