5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine

C18H20ClNO — CID 102848942

IUPAC5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine
SMILESCOCCc1ccccc1NC1Cc2ccc(Cl)cc2C1
InChIInChI=1S/C18H20ClNO/c1-21-9-8-13-4-2-3-5-18(13)20-17-11-14-6-7-16(19)10-15(14)12-17/h2-7,10,17,20H,8-9,11-12H2,1H3
InChIKeyWWSFVOBFTZIBNF-UHFFFAOYSA-N
MW301.82 g/mol
LogP4.11
Rot. Bonds5

About 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine

5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 102848942) has the molecular formula C18H20ClNO and a molecular weight of 301.82 g/mol. Its IUPAC name is 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound Name5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine
PubChem CID102848942
Molecular FormulaC18H20ClNO
Molecular Weight301.82 g/mol
Exact Mass301.12
IUPAC Name5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine
SMILESCOCCc1ccccc1NC1Cc2ccc(Cl)cc2C1
InChIInChI=1S/C18H20ClNO/c1-21-9-8-13-4-2-3-5-18(13)20-17-11-14-6-7-16(19)10-15(14)12-17/h2-7,10,17,20H,8-9,11-12H2,1H3
InChIKeyWWSFVOBFTZIBNF-UHFFFAOYSA-N
XLogP4.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.82
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(2-ethoxyphenyl)-2,3-dihydro-1H-inden-2-amine
CID 115348600
N-cyclobutyl-2-(2-methoxyethyl)aniline
CID 102848928
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)naphthalen-1-amine
CID 115348592
N-[3-bromo-2-(methoxymethyl)phenyl]-5-chloro-2,3-dihydro-1H-inden-2-amine
CID 115348973
5-chloro-N-(2-methoxyethyl)-2,3-dihydro-1H-inden-2-amine
CID 81301364
N-(2-propylphenyl)-2,3-dihydro-1H-inden-2-amine
CID 43687471
N-(4-ethylcyclohexyl)-2-(2-methoxyethyl)aniline
CID 102903852
5-chloro-N-(5-chloro-2-methylphenyl)-2,3-dihydro-1H-inden-2-amine
CID 115348580
N-(3,4-dimethylcyclohexyl)-2-(2-methoxyethyl)aniline
CID 102903864
1-(5-chloro-2,3-dihydro-1H-inden-1-yl)-3-[2-(2-methoxyethyl)phenyl]urea
CID 126793549
5-chloro-N-(4-methoxy-2-methylphenyl)-2,3-dihydro-1H-inden-2-amine
CID 115349039
5-chloro-N-(3-methoxy-2-methylpropyl)-2,3-dihydro-1H-inden-2-amine
CID 81332711

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine (CID 102848942) is 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine is COCCc1ccccc1NC1Cc2ccc(Cl)cc2C1.
What is the InChIKey of 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is WWSFVOBFTZIBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO/c1-21-9-8-13-4-2-3-5-18(13)20-17-11-14-6-7-16(19)10-15(14)12-17/h2-7,10,17,20H,8-9,11-12H2,1H3.
What are the key properties of 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine?
5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 301.82 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(2-methoxyethyl)phenyl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 102848942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).