N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine

C18H21NO — CID 144987034

IUPACN-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine
SMILESCCOc1cccc(N(C)c2ccc3c(c2)CCC3)c1
InChIInChI=1S/C18H21NO/c1-3-20-18-9-5-8-16(13-18)19(2)17-11-10-14-6-4-7-15(14)12-17/h5,8-13H,3-4,6-7H2,1-2H3
InChIKeyJNOUVLVKOGKGSN-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.34
Rot. Bonds4

About N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine

N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine (PubChem CID 144987034) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine.

Molecular Properties

Compound NameN-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine
PubChem CID144987034
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine
SMILESCCOc1cccc(N(C)c2ccc3c(c2)CCC3)c1
InChIInChI=1S/C18H21NO/c1-3-20-18-9-5-8-16(13-18)19(2)17-11-10-14-6-4-7-15(14)12-17/h5,8-13H,3-4,6-7H2,1-2H3
InChIKeyJNOUVLVKOGKGSN-UHFFFAOYSA-N
XLogP4.34
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine
CID 144987112
N-[3-(aminomethyl)phenyl]-N-methyl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 117041504
3-ethoxy-N,N-bis(3-ethoxyphenyl)aniline
CID 70603517
1-N,1-N,4-N-trimethyl-4-N-(5,6,7,8-tetrahydronaphthalen-2-yl)benzene-1,4-diamine
CID 144987164
N-(4-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine;3-(methylamino)pyridine-4-carboxylic acid
CID 144987111
N-[4-(cyclopropylmethoxy)phenyl]-N-methyl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 144986914
N-(4-ethoxyphenyl)-N-methyl-5,6,7,8-tetrahydronaphthalen-2-amine;3-(methylamino)pyridine-4-carboxylic acid
CID 144987131
N-[4-(cyclopropylmethyl)phenyl]-N-methyl-2,3-dihydro-1H-inden-5-amine
CID 155314010
N-(methoxymethyl)-N-methyl-2,3-dihydro-1H-inden-5-amine
CID 115258329
3-(aminomethyl)-N-(4-ethoxyphenyl)-N-methylaniline
CID 117029128
N-(2,3-dihydro-1H-inden-5-yl)-N-methylazetidin-3-amine
CID 117040535
N-(methoxymethyl)-N-methyl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 115258314

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine?
The IUPAC name of N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine (CID 144987034) is N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine.
What is the SMILES notation for N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine?
The canonical SMILES for N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine is CCOc1cccc(N(C)c2ccc3c(c2)CCC3)c1.
What is the InChIKey of N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine?
The InChIKey is JNOUVLVKOGKGSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-3-20-18-9-5-8-16(13-18)19(2)17-11-10-14-6-4-7-15(14)12-17/h5,8-13H,3-4,6-7H2,1-2H3.
What are the key properties of N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine?
N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine has a molecular weight of 267.37 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyphenyl)-N-methyl-2,3-dihydro-1H-inden-5-amine is sourced from PubChem (CID 144987034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).