N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine

C12H17NO — CID 61383418

IUPACN-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine
SMILESCCNC1CCc2c(OC)cccc21
InChIInChI=1S/C12H17NO/c1-3-13-11-8-7-10-9(11)5-4-6-12(10)14-2/h4-6,11,13H,3,7-8H2,1-2H3
InChIKeyCVZZWDFBNOSBQZ-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.29
Rot. Bonds3

About N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine

N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine (PubChem CID 61383418) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine
PubChem CID61383418
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC NameN-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine
SMILESCCNC1CCc2c(OC)cccc21
InChIInChI=1S/C12H17NO/c1-3-13-11-8-7-10-9(11)5-4-6-12(10)14-2/h4-6,11,13H,3,7-8H2,1-2H3
InChIKeyCVZZWDFBNOSBQZ-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-4-(4-methoxybutoxy)-2,3-dihydro-1H-inden-1-amine
CID 104647071
N-ethyl-4-(2-methoxypropoxy)-2,3-dihydro-1H-inden-1-amine
CID 113382709
4-(2-ethoxyethoxy)-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 63091187
N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63822452
2-[[1-(ethylamino)-2,3-dihydro-1H-inden-4-yl]oxy]cyclohexan-1-ol
CID 63090133
4-bromo-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 63272138
N-ethyl-4-(2-methylpentoxy)-2,3-dihydro-1H-inden-1-amine
CID 63091549
2-[[1-(ethylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methoxyethyl)acetamide
CID 63091727
2-[[1-(ethylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N,N-dimethylpropanamide
CID 63091735
2-[1-[[1-(ethylamino)-2,3-dihydro-1H-inden-4-yl]oxymethyl]cyclopropyl]acetonitrile
CID 65481907
N-ethyl-4-[(1-methylpyrazol-4-yl)methoxy]-2,3-dihydro-1H-inden-1-amine
CID 63091008
N-ethyl-5-prop-2-ynoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65456133

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine (CID 61383418) is N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine is CCNC1CCc2c(OC)cccc21.
What is the InChIKey of N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine?
The InChIKey is CVZZWDFBNOSBQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-3-13-11-8-7-10-9(11)5-4-6-12(10)14-2/h4-6,11,13H,3,7-8H2,1-2H3.
What are the key properties of N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine?
N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine has a molecular weight of 191.27 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 61383418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).