2-chloro-N-ethyl-N-(2-methoxyethyl)aniline

C11H16ClNO — CID 139729852

IUPAC2-chloro-N-ethyl-N-(2-methoxyethyl)aniline
SMILESCCN(CCOC)c1ccccc1Cl
InChIInChI=1S/C11H16ClNO/c1-3-13(8-9-14-2)11-7-5-4-6-10(11)12/h4-7H,3,8-9H2,1-2H3
InChIKeyNHBZJOAPGCXDLO-UHFFFAOYSA-N
MW213.71 g/mol
LogP2.81
Rot. Bonds5

About 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline

2-chloro-N-ethyl-N-(2-methoxyethyl)aniline (PubChem CID 139729852) has the molecular formula C11H16ClNO and a molecular weight of 213.71 g/mol. Its IUPAC name is 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline.

Molecular Properties

Compound Name2-chloro-N-ethyl-N-(2-methoxyethyl)aniline
PubChem CID139729852
Molecular FormulaC11H16ClNO
Molecular Weight213.71 g/mol
Exact Mass213.09
IUPAC Name2-chloro-N-ethyl-N-(2-methoxyethyl)aniline
SMILESCCN(CCOC)c1ccccc1Cl
InChIInChI=1S/C11H16ClNO/c1-3-13(8-9-14-2)11-7-5-4-6-10(11)12/h4-7H,3,8-9H2,1-2H3
InChIKeyNHBZJOAPGCXDLO-UHFFFAOYSA-N
XLogP2.81
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-N-ethylanilino)ethanol
CID 70558139
2-(1-aminopropyl)-N-ethyl-N-(2-methoxyethyl)aniline
CID 112678005
2-(2-aminobutyl)-N-ethyl-N-(2-methoxyethyl)aniline
CID 55236804
3-chloro-N,N-bis(2-methoxyethyl)-2-(methylaminomethyl)aniline
CID 61418447
2-[bis(2-methoxyethyl)amino]-6-chlorobenzenecarbothioamide
CID 62496660
N-butyl-3-chloro-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline
CID 63058912
2-amino-3-[ethyl(2-methoxyethyl)amino]benzonitrile
CID 104716449
2-chloro-N,N-dihexylaniline
CID 139723528
2-chloro-6-[2-methoxyethyl(3-methoxypropyl)amino]benzaldehyde
CID 54989930
2-(2-chlorophenyl)-1-N,1-N-bis(2-methoxyethyl)benzene-1,4-diamine
CID 18371796
N'-ethyl-N-(2-methoxyethyl)-N'-(2-methylphenyl)ethane-1,2-diamine
CID 62575841
3-chloro-1-N-(2-methoxyethyl)-1-N-methylbenzene-1,2-diamine
CID 104834240

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline?
The IUPAC name of 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline (CID 139729852) is 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline.
What is the SMILES notation for 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline?
The canonical SMILES for 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline is CCN(CCOC)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline?
The InChIKey is NHBZJOAPGCXDLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClNO/c1-3-13(8-9-14-2)11-7-5-4-6-10(11)12/h4-7H,3,8-9H2,1-2H3.
What are the key properties of 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline?
2-chloro-N-ethyl-N-(2-methoxyethyl)aniline has a molecular weight of 213.71 g/mol, XLogP of 2.81, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-N-(2-methoxyethyl)aniline is sourced from PubChem (CID 139729852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).