2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine

C18H29NO2 — CID 103487452

IUPAC2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCNC1c2ccccc2CCC1OC(C)COCC
InChIInChI=1S/C18H29NO2/c1-4-12-19-18-16-9-7-6-8-15(16)10-11-17(18)21-14(3)13-20-5-2/h6-9,14,17-19H,4-5,10-13H2,1-3H3
InChIKeyLRNMOBFXNOYOCF-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.48
Rot. Bonds8

About 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine

2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 103487452) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID103487452
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCNC1c2ccccc2CCC1OC(C)COCC
InChIInChI=1S/C18H29NO2/c1-4-12-19-18-16-9-7-6-8-15(16)10-11-17(18)21-14(3)13-20-5-2/h6-9,14,17-19H,4-5,10-13H2,1-3H3
InChIKeyLRNMOBFXNOYOCF-UHFFFAOYSA-N
XLogP3.48
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-ethoxypropan-2-yloxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 103489692
2-(2-methylpropyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63403727
2-(1-methoxypropan-2-yloxy)-4-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419271
2-[2-(2-methylpropoxy)ethoxy]-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 106447311
2-N-methyl-2-N-(3-methylbutan-2-yl)-1-N-propyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 63469194
2-N-methyl-2-N-(2-methylbutyl)-1-N-propyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 63467737
2-methylsulfinyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64654603
2-(cyclopentylmethoxy)-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 66322610
2-(cyclopentylmethyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63403595
3-(1-ethoxypropan-2-yloxy)-2,3,4,5-tetrahydro-1H-1-benzazepine
CID 103490774
6-(2-ethylbutyl)-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 82932652
2-prop-2-enylsulfanyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 114272345

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 103487452) is 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine is CCCNC1c2ccccc2CCC1OC(C)COCC.
What is the InChIKey of 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is LRNMOBFXNOYOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-4-12-19-18-16-9-7-6-8-15(16)10-11-17(18)21-14(3)13-20-5-2/h6-9,14,17-19H,4-5,10-13H2,1-3H3.
What are the key properties of 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 291.44 g/mol, XLogP of 3.48, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxypropan-2-yloxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 103487452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).