N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine

C13H15N3 — CID 79034324

IUPACN-[2-(2-methylphenyl)ethyl]pyridazin-3-amine
SMILESCc1ccccc1CCNc1cccnn1
InChIInChI=1S/C13H15N3/c1-11-5-2-3-6-12(11)8-10-14-13-7-4-9-15-16-13/h2-7,9H,8,10H2,1H3,(H,14,16)
InChIKeyUKEFAIPMHWABEK-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.44
Rot. Bonds4

About N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine

N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine (PubChem CID 79034324) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[2-(2-methylphenyl)ethyl]pyridazin-3-amine
PubChem CID79034324
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC NameN-[2-(2-methylphenyl)ethyl]pyridazin-3-amine
SMILESCc1ccccc1CCNc1cccnn1
InChIInChI=1S/C13H15N3/c1-11-5-2-3-6-12(11)8-10-14-13-7-4-9-15-16-13/h2-7,9H,8,10H2,1H3,(H,14,16)
InChIKeyUKEFAIPMHWABEK-UHFFFAOYSA-N
XLogP2.44
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine
CID 106549855
4-N-[2-(2-methylphenyl)ethyl]pyrimidine-2,4-diamine
CID 80850064
6-methoxy-N-[2-(2-methylphenyl)ethyl]pyridin-2-amine
CID 79756545
2-[2-(2-methylphenyl)ethylamino]pyridine-4-carboxylic acid
CID 112723330
2-[2-(2-methylphenyl)ethylamino]pyridine-4-carbonitrile
CID 79749854
4-N-[2-(2-methylphenyl)ethyl]pyrimidine-2,4,6-triamine
CID 80849672
N-(2-thiophen-2-ylethyl)pyridazin-3-amine
CID 62481413
6-chloro-N-[2-(2-methylphenyl)ethyl]pyrazin-2-amine
CID 47151369
N-[2-(1H-imidazol-5-yl)ethyl]pyridazin-3-amine
CID 65231842
N-[2-(2-methylphenyl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 115601227
N-[2-(2-methylphenyl)ethyl]quinolin-4-amine
CID 79755193
5,6-dimethyl-3-[2-(2-methylphenyl)ethylamino]pyridazine-4-carbonitrile
CID 31536211

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine?
The IUPAC name of N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine (CID 79034324) is N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine.
What is the SMILES notation for N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine?
The canonical SMILES for N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine is Cc1ccccc1CCNc1cccnn1.
What is the InChIKey of N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine?
The InChIKey is UKEFAIPMHWABEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-11-5-2-3-6-12(11)8-10-14-13-7-4-9-15-16-13/h2-7,9H,8,10H2,1H3,(H,14,16).
What are the key properties of N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine?
N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine has a molecular weight of 213.28 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine is sourced from PubChem (CID 79034324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).