3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine

C18H27NO — CID 79619329

IUPAC3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCCC(Oc2ccc3c(c2)CCC3)C1
InChIInChI=1S/C18H27NO/c1-2-11-19-16-7-4-8-17(13-16)20-18-10-9-14-5-3-6-15(14)12-18/h9-10,12,16-17,19H,2-8,11,13H2,1H3
InChIKeyMUCSHBDNYOBGMH-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.86
Rot. Bonds5

About 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine

3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine (PubChem CID 79619329) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine
PubChem CID79619329
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCCC(Oc2ccc3c(c2)CCC3)C1
InChIInChI=1S/C18H27NO/c1-2-11-19-16-7-4-8-17(13-16)20-18-10-9-14-5-3-6-15(14)12-18/h9-10,12,16-17,19H,2-8,11,13H2,1H3
InChIKeyMUCSHBDNYOBGMH-UHFFFAOYSA-N
XLogP3.86
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-fluoro-4-methylphenoxy)-N-propylcyclohexan-1-amine
CID 107169056
3-(4-ethylphenoxy)-N-propylcyclohexan-1-amine
CID 79617884
N-propyl-3-quinolin-7-yloxycyclohexan-1-amine
CID 107313463
3-(2,3-dihydro-1H-inden-5-yloxy)-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 66358217
N-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]cycloheptanamine
CID 63516362
N-[3-(2,3-dihydro-1H-inden-5-yloxy)propyl]cyclopropanamine
CID 29015190
2-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]-N-propylcyclopentan-1-amine
CID 79576350
3-(3,4-dimethylphenoxy)-N-propylcyclobutan-1-amine
CID 66359131
N-[3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propyl]cyclopropanamine
CID 61398719
[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol
CID 79646252
3-(4-ethyl-2-methoxyphenoxy)-N-propylcyclohexan-1-amine
CID 107664429
3-(2,3-dihydro-1H-inden-5-yloxy)cyclopentan-1-amine
CID 79643609

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine?
The IUPAC name of 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine (CID 79619329) is 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine.
What is the SMILES notation for 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine?
The canonical SMILES for 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine is CCCNC1CCCC(Oc2ccc3c(c2)CCC3)C1.
What is the InChIKey of 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine?
The InChIKey is MUCSHBDNYOBGMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-2-11-19-16-7-4-8-17(13-16)20-18-10-9-14-5-3-6-15(14)12-18/h9-10,12,16-17,19H,2-8,11,13H2,1H3.
What are the key properties of 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine?
3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine has a molecular weight of 273.42 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-inden-5-yloxy)-N-propylcyclohexan-1-amine is sourced from PubChem (CID 79619329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).