2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline

C12H16Cl2N2O — CID 28774944

IUPAC2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline
SMILESClc1cccc(NCCN2CCOCC2)c1Cl
InChIInChI=1S/C12H16Cl2N2O/c13-10-2-1-3-11(12(10)14)15-4-5-16-6-8-17-9-7-16/h1-3,15H,4-9H2
InChIKeyCNYMMVPGQVMINH-UHFFFAOYSA-N
MW275.18 g/mol
LogP2.74
Rot. Bonds4

About 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline

2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline (PubChem CID 28774944) has the molecular formula C12H16Cl2N2O and a molecular weight of 275.18 g/mol. Its IUPAC name is 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline.

Molecular Properties

Compound Name2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline
PubChem CID28774944
Molecular FormulaC12H16Cl2N2O
Molecular Weight275.18 g/mol
Exact Mass274.06
IUPAC Name2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline
SMILESClc1cccc(NCCN2CCOCC2)c1Cl
InChIInChI=1S/C12H16Cl2N2O/c13-10-2-1-3-11(12(10)14)15-4-5-16-6-8-17-9-7-16/h1-3,15H,4-9H2
InChIKeyCNYMMVPGQVMINH-UHFFFAOYSA-N
XLogP2.74
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dichloro-N-[2-(4-methylpiperazin-1-yl)ethyl]aniline
CID 79016629
N-(2,3-dichlorophenyl)-2-(2-morpholin-4-ylethylamino)pyrimidine-5-carboxamide
CID 109253299
4-bromo-2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline
CID 107789141
N-(2,3-dichlorophenyl)-2,2-dimethyl-N'-(2-morpholin-4-ylethyl)propanediamide
CID 108960486
N-(2,3-dichlorophenyl)-4-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
CID 109207708
2-chloro-1-N-(2-morpholin-4-ylethyl)benzene-1,4-diamine
CID 28904413
2-chloro-N-(2-pyrrolidin-1-ylethyl)aniline
CID 62573332
3-chloro-1-N-(2-pyrrolidin-1-ylethyl)benzene-1,2-diamine
CID 104834468
4-chloro-2-fluoro-N-(2-morpholin-4-ylethyl)aniline
CID 60679405
2,3-dichloro-N-[2-(2,3-dihydroindol-1-yl)ethyl]aniline
CID 54806092
4-chloro-N-(2-morpholin-4-ylethyl)aniline
CID 28580807
2-methylsulfonyl-N-(2-morpholin-4-ylethyl)aniline
CID 43388034

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline?
The IUPAC name of 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline (CID 28774944) is 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline.
What is the SMILES notation for 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline?
The canonical SMILES for 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline is Clc1cccc(NCCN2CCOCC2)c1Cl.
What is the InChIKey of 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline?
The InChIKey is CNYMMVPGQVMINH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O/c13-10-2-1-3-11(12(10)14)15-4-5-16-6-8-17-9-7-16/h1-3,15H,4-9H2.
What are the key properties of 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline?
2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline has a molecular weight of 275.18 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-(2-morpholin-4-ylethyl)aniline is sourced from PubChem (CID 28774944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).