N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine

C12H11Cl2N3 — CID 175554568

IUPACN-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine
SMILESClc1ccc(Cl)c(CCNc2ccnnc2)c1
InChIInChI=1S/C12H11Cl2N3/c13-10-1-2-12(14)9(7-10)3-5-15-11-4-6-16-17-8-11/h1-2,4,6-8H,3,5H2,(H,15,16)
InChIKeyIWIGDPRGVPQLMJ-UHFFFAOYSA-N
MW268.15 g/mol
LogP3.44
Rot. Bonds4

About N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine

N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine (PubChem CID 175554568) has the molecular formula C12H11Cl2N3 and a molecular weight of 268.15 g/mol. Its IUPAC name is N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine.

Molecular Properties

Compound NameN-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine
PubChem CID175554568
Molecular FormulaC12H11Cl2N3
Molecular Weight268.15 g/mol
Exact Mass267.03
IUPAC NameN-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine
SMILESClc1ccc(Cl)c(CCNc2ccnnc2)c1
InChIInChI=1S/C12H11Cl2N3/c13-10-1-2-12(14)9(7-10)3-5-15-11-4-6-16-17-8-11/h1-2,4,6-8H,3,5H2,(H,15,16)
InChIKeyIWIGDPRGVPQLMJ-UHFFFAOYSA-N
XLogP3.44
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.15
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,5-dichlorophenyl)ethyl]aniline
CID 63952494
6-N-[2-(2,5-dichlorophenyl)ethyl]-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine
CID 166326818
2-(2,5-dichlorophenyl)-1-pyridazin-4-ylethanol
CID 105100348
1,4-dichloro-2-[2-(2,4-dichlorophenyl)ethyl]benzene
CID 173469759
N-[2-(2,5-dichlorophenyl)ethyl]-N'-propan-2-ylethane-1,2-diamine
CID 113405304
1,4-dichloro-2-(fluoromethyl)benzene
CID 175609206
[4-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203694
N-[2-(2,4-dichlorophenyl)ethyl]-4-(trifluoromethyl)aniline
CID 63536432
3-N-(4-chlorophenyl)-5-N-[2-(2,4-dichlorophenyl)ethyl]-1,2,4-triazine-3,5-diamine
CID 112961209
N-[(2,5-dichlorophenyl)methyl]-5-methylpyridin-3-amine
CID 103845205
N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 113031057
3-N-[2-(2,4-dichlorophenyl)ethyl]-5-N-(3,4-difluorophenyl)-1,2,4-triazine-3,5-diamine
CID 112961243

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine?
The IUPAC name of N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine (CID 175554568) is N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine.
What is the SMILES notation for N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine?
The canonical SMILES for N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine is Clc1ccc(Cl)c(CCNc2ccnnc2)c1.
What is the InChIKey of N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine?
The InChIKey is IWIGDPRGVPQLMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3/c13-10-1-2-12(14)9(7-10)3-5-15-11-4-6-16-17-8-11/h1-2,4,6-8H,3,5H2,(H,15,16).
What are the key properties of N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine?
N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine has a molecular weight of 268.15 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine is sourced from PubChem (CID 175554568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).