5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline

C15H20ClNO — CID 54865533

IUPAC5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline
SMILESCCOc1ccc(Cl)cc1NC(C1CC1)C1CC1
InChIInChI=1S/C15H20ClNO/c1-2-18-14-8-7-12(16)9-13(14)17-15(10-3-4-10)11-5-6-11/h7-11,15,17H,2-6H2,1H3
InChIKeyKGMLRGJQWZMMRI-UHFFFAOYSA-N
MW265.78 g/mol
LogP4.34
Rot. Bonds6

About 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline

5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline (PubChem CID 54865533) has the molecular formula C15H20ClNO and a molecular weight of 265.78 g/mol. Its IUPAC name is 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline.

Molecular Properties

Compound Name5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline
PubChem CID54865533
Molecular FormulaC15H20ClNO
Molecular Weight265.78 g/mol
Exact Mass265.12
IUPAC Name5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline
SMILESCCOc1ccc(Cl)cc1NC(C1CC1)C1CC1
InChIInChI=1S/C15H20ClNO/c1-2-18-14-8-7-12(16)9-13(14)17-15(10-3-4-10)11-5-6-11/h7-11,15,17H,2-6H2,1H3
InChIKeyKGMLRGJQWZMMRI-UHFFFAOYSA-N
XLogP4.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.78
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-2-ethoxy-N-(3-methylpentan-2-yl)aniline
CID 63451120
5-chloro-N-[1-(4-chlorophenyl)ethyl]-2-ethoxyaniline
CID 63451342
N-(5-chloro-2-ethoxyphenyl)cycloheptanamine
CID 55191401
5-chloro-2-ethoxy-N-hexan-2-ylaniline
CID 63451337
5-chloro-N-[1-(2-chlorophenyl)ethyl]-2-ethoxyaniline
CID 63451432
N-(5-chloro-2-ethoxyphenyl)oxan-4-amine
CID 54865465
5-chloro-2-ethoxy-N-[1-(4-methoxyphenyl)ethyl]aniline
CID 60935115
5-chloro-N-[1-(3,4-dimethylphenyl)ethyl]-2-ethoxyaniline
CID 63451474
5-chloro-N-[(5-chloro-2-fluorophenyl)methyl]-2-ethoxyaniline
CID 114842110
N-[1-(5-bromo-2-fluorophenyl)ethyl]-5-chloro-2-ethoxyaniline
CID 82963216
N-(5-chloro-2-ethoxyphenyl)piperidine-4-carboxamide
CID 54862625
N-(5-chloro-2-ethoxyphenyl)-2-(cyclopropylmethylamino)acetamide
CID 54862706

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline?
The IUPAC name of 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline (CID 54865533) is 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline.
What is the SMILES notation for 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline?
The canonical SMILES for 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline is CCOc1ccc(Cl)cc1NC(C1CC1)C1CC1.
What is the InChIKey of 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline?
The InChIKey is KGMLRGJQWZMMRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO/c1-2-18-14-8-7-12(16)9-13(14)17-15(10-3-4-10)11-5-6-11/h7-11,15,17H,2-6H2,1H3.
What are the key properties of 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline?
5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline has a molecular weight of 265.78 g/mol, XLogP of 4.34, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(dicyclopropylmethyl)-2-ethoxyaniline is sourced from PubChem (CID 54865533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).