N-ethyl-6-methyl-5-phenylpyridazin-4-amine

C13H15N3 — CID 70479630

IUPACN-ethyl-6-methyl-5-phenylpyridazin-4-amine
SMILESCCNc1cnnc(C)c1-c1ccccc1
InChIInChI=1S/C13H15N3/c1-3-14-12-9-15-16-10(2)13(12)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H,14,16)
InChIKeyCRCNSQMXIACGDW-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.88
Rot. Bonds3

About N-ethyl-6-methyl-5-phenylpyridazin-4-amine

N-ethyl-6-methyl-5-phenylpyridazin-4-amine (PubChem CID 70479630) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-ethyl-6-methyl-5-phenylpyridazin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-methyl-5-phenylpyridazin-4-amine
PubChem CID70479630
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC NameN-ethyl-6-methyl-5-phenylpyridazin-4-amine
SMILESCCNc1cnnc(C)c1-c1ccccc1
InChIInChI=1S/C13H15N3/c1-3-14-12-9-15-16-10(2)13(12)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H,14,16)
InChIKeyCRCNSQMXIACGDW-UHFFFAOYSA-N
XLogP2.88
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methyl-5-phenylpyridazin-4-amine?
The IUPAC name of N-ethyl-6-methyl-5-phenylpyridazin-4-amine (CID 70479630) is N-ethyl-6-methyl-5-phenylpyridazin-4-amine.
What is the SMILES notation for N-ethyl-6-methyl-5-phenylpyridazin-4-amine?
The canonical SMILES for N-ethyl-6-methyl-5-phenylpyridazin-4-amine is CCNc1cnnc(C)c1-c1ccccc1.
What is the InChIKey of N-ethyl-6-methyl-5-phenylpyridazin-4-amine?
The InChIKey is CRCNSQMXIACGDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-3-14-12-9-15-16-10(2)13(12)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H,14,16).
What are the key properties of N-ethyl-6-methyl-5-phenylpyridazin-4-amine?
N-ethyl-6-methyl-5-phenylpyridazin-4-amine has a molecular weight of 213.28 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methyl-5-phenylpyridazin-4-amine is sourced from PubChem (CID 70479630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).