N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine

C19H29NO — CID 107683841

IUPACN-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine
SMILESCCNC1CCc2cc(OC3CCCCC3CC)ccc21
InChIInChI=1S/C19H29NO/c1-3-14-7-5-6-8-19(14)21-16-10-11-17-15(13-16)9-12-18(17)20-4-2/h10-11,13-14,18-20H,3-9,12H2,1-2H3
InChIKeyOPJMCDBDWBCRCL-UHFFFAOYSA-N
MW287.45 g/mol
LogP4.63
Rot. Bonds5

About N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine

N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine (PubChem CID 107683841) has the molecular formula C19H29NO and a molecular weight of 287.45 g/mol. Its IUPAC name is N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine
PubChem CID107683841
Molecular FormulaC19H29NO
Molecular Weight287.45 g/mol
Exact Mass287.22
IUPAC NameN-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine
SMILESCCNC1CCc2cc(OC3CCCCC3CC)ccc21
InChIInChI=1S/C19H29NO/c1-3-14-7-5-6-8-19(14)21-16-10-11-17-15(13-16)9-12-18(17)20-4-2/h10-11,13-14,18-20H,3-9,12H2,1-2H3
InChIKeyOPJMCDBDWBCRCL-UHFFFAOYSA-N
XLogP4.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-ethylcyclohexyl)oxy-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 107683560
5-but-2-ynoxy-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 107683611
2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide
CID 107683580
5-[2-(diethylamino)ethoxy]-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 107683747
1-bromo-3-(2-ethylcyclohexyl)oxybenzene
CID 63863406
N-ethyl-5-pent-4-ynoxy-2,3-dihydro-1H-inden-1-amine
CID 107683662
1-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]-3-methoxypropan-2-ol
CID 107683826
3-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxymethyl]phenol
CID 107683685
ethyl 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]propanoate
CID 107683817
N-ethyl-5-[(2-methylphenyl)methoxy]-2,3-dihydro-1H-inden-1-amine
CID 107683619
1-ethyl-4-(2-ethylcyclohexyl)oxybenzene
CID 64764923
N-ethyl-1-[3-(2-ethylcyclohexyl)oxyphenyl]ethanamine
CID 63863196

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine (CID 107683841) is N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine is CCNC1CCc2cc(OC3CCCCC3CC)ccc21.
What is the InChIKey of N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine?
The InChIKey is OPJMCDBDWBCRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO/c1-3-14-7-5-6-8-19(14)21-16-10-11-17-15(13-16)9-12-18(17)20-4-2/h10-11,13-14,18-20H,3-9,12H2,1-2H3.
What are the key properties of N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine?
N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine has a molecular weight of 287.45 g/mol, XLogP of 4.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 107683841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).