N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine

C14H15N3 — CID 114009022

IUPACN-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine
SMILESCc1cnnc(NC2Cc3ccccc3C2)c1
InChIInChI=1S/C14H15N3/c1-10-6-14(17-15-9-10)16-13-7-11-4-2-3-5-12(11)8-13/h2-6,9,13H,7-8H2,1H3,(H,16,17)
InChIKeySUWKFPJVWANJLK-UHFFFAOYSA-N
MW225.30 g/mol
LogP2.36
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine

N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine (PubChem CID 114009022) has the molecular formula C14H15N3 and a molecular weight of 225.30 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine
PubChem CID114009022
Molecular FormulaC14H15N3
Molecular Weight225.30 g/mol
Exact Mass225.13
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine
SMILESCc1cnnc(NC2Cc3ccccc3C2)c1
InChIInChI=1S/C14H15N3/c1-10-6-14(17-15-9-10)16-13-7-11-4-2-3-5-12(11)8-13/h2-6,9,13H,7-8H2,1H3,(H,16,17)
InChIKeySUWKFPJVWANJLK-UHFFFAOYSA-N
XLogP2.36
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine (CID 114009022) is N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine is Cc1cnnc(NC2Cc3ccccc3C2)c1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine?
The InChIKey is SUWKFPJVWANJLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3/c1-10-6-14(17-15-9-10)16-13-7-11-4-2-3-5-12(11)8-13/h2-6,9,13H,7-8H2,1H3,(H,16,17).
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine?
N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine has a molecular weight of 225.30 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-5-methylpyridazin-3-amine is sourced from PubChem (CID 114009022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).