N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine

C13H19NO — CID 88611694

IUPACN-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
SMILESCCCNOc1ccc2c(c1)CCCC2
InChIInChI=1S/C13H19NO/c1-2-9-14-15-13-8-7-11-5-3-4-6-12(11)10-13/h7-8,10,14H,2-6,9H2,1H3
InChIKeyJEGVXMODVWRHDF-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.86
Rot. Bonds4

About N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine

N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine (PubChem CID 88611694) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine.

Molecular Properties

Compound NameN-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
PubChem CID88611694
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
SMILESCCCNOc1ccc2c(c1)CCCC2
InChIInChI=1S/C13H19NO/c1-2-9-14-15-13-8-7-11-5-3-4-6-12(11)10-13/h7-8,10,14H,2-6,9H2,1H3
InChIKeyJEGVXMODVWRHDF-UHFFFAOYSA-N
XLogP2.86
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-methyl-N-propyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-1-amine
CID 63496310
N-propyl-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pentan-2-amine
CID 64718686
5-(2,3-dihydro-1H-inden-5-yloxy)-N-propylpentan-1-amine
CID 55077053
2-methyl-2-(propylamino)-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-ol
CID 64810615
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-1-amine
CID 43163737
N-ethyl-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-1-amine
CID 55075397
3-(2,3-dihydro-1H-inden-5-yloxy)-2-methyl-N-propylpropan-1-amine
CID 62459278
2-(2,3-dihydro-1H-inden-5-yloxy)-N-methylethanamine
CID 14809522
[3-(2,3-dihydro-1H-inden-5-yloxy)-1-(propylamino)cyclopentyl]methanol
CID 79646252
1-(2,3-dihydro-1H-inden-5-yloxy)-3-(propylamino)propan-2-ol
CID 43166218
N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide
CID 113101532
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(propylcarbamoyl)acetamide
CID 7642995

Frequently Asked Questions

What is the IUPAC name of N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine?
The IUPAC name of N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine (CID 88611694) is N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine.
What is the SMILES notation for N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine?
The canonical SMILES for N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine is CCCNOc1ccc2c(c1)CCCC2.
What is the InChIKey of N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine?
The InChIKey is JEGVXMODVWRHDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-2-9-14-15-13-8-7-11-5-3-4-6-12(11)10-13/h7-8,10,14H,2-6,9H2,1H3.
What are the key properties of N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine?
N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine is sourced from PubChem (CID 88611694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).