N-[2-(2,5-dichlorophenyl)ethyl]aniline

C14H13Cl2N — CID 63952494

IUPACN-[2-(2,5-dichlorophenyl)ethyl]aniline
SMILESClc1ccc(Cl)c(CCNc2ccccc2)c1
InChIInChI=1S/C14H13Cl2N/c15-12-6-7-14(16)11(10-12)8-9-17-13-4-2-1-3-5-13/h1-7,10,17H,8-9H2
InChIKeyKWXHVEVZEMIEDZ-UHFFFAOYSA-N
MW266.17 g/mol
LogP4.65
Rot. Bonds4

About N-[2-(2,5-dichlorophenyl)ethyl]aniline

N-[2-(2,5-dichlorophenyl)ethyl]aniline (PubChem CID 63952494) has the molecular formula C14H13Cl2N and a molecular weight of 266.17 g/mol. Its IUPAC name is N-[2-(2,5-dichlorophenyl)ethyl]aniline.

Molecular Properties

Compound NameN-[2-(2,5-dichlorophenyl)ethyl]aniline
PubChem CID63952494
Molecular FormulaC14H13Cl2N
Molecular Weight266.17 g/mol
Exact Mass265.04
IUPAC NameN-[2-(2,5-dichlorophenyl)ethyl]aniline
SMILESClc1ccc(Cl)c(CCNc2ccccc2)c1
InChIInChI=1S/C14H13Cl2N/c15-12-6-7-14(16)11(10-12)8-9-17-13-4-2-1-3-5-13/h1-7,10,17H,8-9H2
InChIKeyKWXHVEVZEMIEDZ-UHFFFAOYSA-N
XLogP4.65
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.17
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2,5-dichlorophenyl)ethyl]pyridazin-4-amine
CID 175554568
N'-(2,4-dichlorophenyl)-N-phenylethane-1,2-diamine
CID 54806465
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
N-[2-(2,4-dichlorophenyl)ethyl]-4-(trifluoromethyl)aniline
CID 63536432
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
2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol
CID 103845164
4-bromo-N-[(2,5-dichlorophenyl)methyl]aniline
CID 65315845
4-(1-aminoethyl)-N-[2-(2,4-dichlorophenyl)ethyl]aniline
CID 130243936
N,N'-bis(3-chlorophenyl)ethane-1,2-diamine
CID 14274750
3-(chloromethyl)-N-[(2,5-dichlorophenyl)methyl]aniline
CID 65318262

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dichlorophenyl)ethyl]aniline?
The IUPAC name of N-[2-(2,5-dichlorophenyl)ethyl]aniline (CID 63952494) is N-[2-(2,5-dichlorophenyl)ethyl]aniline.
What is the SMILES notation for N-[2-(2,5-dichlorophenyl)ethyl]aniline?
The canonical SMILES for N-[2-(2,5-dichlorophenyl)ethyl]aniline is Clc1ccc(Cl)c(CCNc2ccccc2)c1.
What is the InChIKey of N-[2-(2,5-dichlorophenyl)ethyl]aniline?
The InChIKey is KWXHVEVZEMIEDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2N/c15-12-6-7-14(16)11(10-12)8-9-17-13-4-2-1-3-5-13/h1-7,10,17H,8-9H2.
What are the key properties of N-[2-(2,5-dichlorophenyl)ethyl]aniline?
N-[2-(2,5-dichlorophenyl)ethyl]aniline has a molecular weight of 266.17 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dichlorophenyl)ethyl]aniline is sourced from PubChem (CID 63952494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).