N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine

C19H23NO — CID 43104651

IUPACN-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine
SMILESCCOc1ccc(C(C)Nc2ccc3c(c2)CCC3)cc1
InChIInChI=1S/C19H23NO/c1-3-21-19-11-8-15(9-12-19)14(2)20-18-10-7-16-5-4-6-17(16)13-18/h7-14,20H,3-6H2,1-2H3
InChIKeyPJKGHZYAKJUWAV-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.75
Rot. Bonds5

About N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine

N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine (PubChem CID 43104651) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine.

Molecular Properties

Compound NameN-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine
PubChem CID43104651
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine
SMILESCCOc1ccc(C(C)Nc2ccc3c(c2)CCC3)cc1
InChIInChI=1S/C19H23NO/c1-3-21-19-11-8-15(9-12-19)14(2)20-18-10-7-16-5-4-6-17(16)13-18/h7-14,20H,3-6H2,1-2H3
InChIKeyPJKGHZYAKJUWAV-UHFFFAOYSA-N
XLogP4.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-chlorophenyl)ethyl]-2,3-dihydro-1H-inden-5-amine
CID 43096931
4-chloro-N-[1-(4-ethoxyphenyl)ethyl]-3-fluoroaniline
CID 43721449
N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline
CID 43093553
N-(2,3-dihydro-1H-inden-5-yl)-4-ethoxybenzamide
CID 2673454
N-[1-(4-ethoxyphenyl)ethyl]-1,3-benzothiazol-6-amine
CID 107803950
[(2R)-1-(4-ethoxyanilino)-1-oxopropan-2-yl] 2-(2,3-dihydro-1H-inden-5-yl)acetate
CID 8949828
2-[4-[1-(4-ethoxyphenyl)ethylamino]phenyl]ethanol
CID 61236951
N-[1-(2,3-dihydro-1H-inden-5-yl)ethyl]-3-fluoro-4-methylaniline
CID 43096117
N-[1-(2,3-dihydro-1H-inden-5-yl)ethyl]-3,5-dimethylaniline
CID 43100562
N-(4-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine
CID 144987112
N-[1-(2,5-dimethylphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine
CID 43109710
N-[1-(4-methoxyphenyl)ethyl]-1-methyl-3,4-dihydro-2H-quinolin-6-amine
CID 82538735

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine?
The IUPAC name of N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine (CID 43104651) is N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine.
What is the SMILES notation for N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine?
The canonical SMILES for N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine is CCOc1ccc(C(C)Nc2ccc3c(c2)CCC3)cc1.
What is the InChIKey of N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine?
The InChIKey is PJKGHZYAKJUWAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-3-21-19-11-8-15(9-12-19)14(2)20-18-10-7-16-5-4-6-17(16)13-18/h7-14,20H,3-6H2,1-2H3.
What are the key properties of N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine?
N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine has a molecular weight of 281.40 g/mol, XLogP of 4.75, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine is sourced from PubChem (CID 43104651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).