6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine

C18H27NO — CID 64748271

IUPAC6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCC1CCC(Oc2ccc3c(c2)CCCC3N)CC1
InChIInChI=1S/C18H27NO/c1-2-13-6-8-15(9-7-13)20-16-10-11-17-14(12-16)4-3-5-18(17)19/h10-13,15,18H,2-9,19H2,1H3
InChIKeyNNEWVZQJABUMSZ-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.37
Rot. Bonds3

About 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine

6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 64748271) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID64748271
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCC1CCC(Oc2ccc3c(c2)CCCC3N)CC1
InChIInChI=1S/C18H27NO/c1-2-13-6-8-15(9-7-13)20-16-10-11-17-14(12-16)4-3-5-18(17)19/h10-13,15,18H,2-9,19H2,1H3
InChIKeyNNEWVZQJABUMSZ-UHFFFAOYSA-N
XLogP4.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(4-ethylcyclohexyl)oxy-3,4-dihydro-2H-naphthalen-1-one
CID 64748496
6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 80698721
(1S)-5-ethoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 70817218
1-(4-ethylcyclohexyl)oxy-3-fluorobenzene
CID 64766217
3-[(5-amino-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]propane-1,2-diol
CID 82850996
3-ethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 62737273
(5S)-3-ethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 79014278
7-(4-ethylcyclohexyl)oxy-3,4-dihydro-1H-quinolin-2-one
CID 114940266
6-N-methyl-1,2,3,4-tetrahydronaphthalene-1,6-diamine
CID 83816639
1-tert-butyl-4-(4-ethylcyclohexyl)oxybenzene
CID 64764201
2-[4-(4-ethylcyclohexyl)oxyphenyl]ethanol
CID 107709472
3-(2,3-dihydro-1H-inden-5-yloxy)cyclopentan-1-amine
CID 79643609

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine (CID 64748271) is 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine is CCC1CCC(Oc2ccc3c(c2)CCCC3N)CC1.
What is the InChIKey of 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is NNEWVZQJABUMSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-2-13-6-8-15(9-7-13)20-16-10-11-17-14(12-16)4-3-5-18(17)19/h10-13,15,18H,2-9,19H2,1H3.
What are the key properties of 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine?
6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 273.42 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 64748271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).