7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde

C17H25NO — CID 15230497

IUPAC7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde
SMILESCCCN(CCC)C1CCc2cccc(C=O)c2C1
InChIInChI=1S/C17H25NO/c1-3-10-18(11-4-2)16-9-8-14-6-5-7-15(13-19)17(14)12-16/h5-7,13,16H,3-4,8-12H2,1-2H3
InChIKeyRIWWLJMHYNWZAL-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.48
Rot. Bonds6

About 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde

7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde (PubChem CID 15230497) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde.

Molecular Properties

Compound Name7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde
PubChem CID15230497
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde
SMILESCCCN(CCC)C1CCc2cccc(C=O)c2C1
InChIInChI=1S/C17H25NO/c1-3-10-18(11-4-2)16-9-8-14-6-5-7-15(13-19)17(14)12-16/h5-7,13,16H,3-4,8-12H2,1-2H3
InChIKeyRIWWLJMHYNWZAL-UHFFFAOYSA-N
XLogP3.48
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

(7R)-7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 6603866
2-[7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]-N-methylethenesulfonamide
CID 54083145
N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 15908435
1-[(7R)-7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]propan-1-one
CID 54473836
1-[7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]pentan-1-one
CID 10087077
(E)-3-(dimethylamino)-1-[7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]prop-2-en-1-one
CID 15222437
N,N-dipropyl-8-(1,3,5-triazin-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 23373523
(2R)-8-(4-fluorophenyl)-N,N-dipropyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 10426492
N-[1-[7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]ethylidene]hydroxylamine
CID 74044271
(7S)-7-[[(E)-3-iodoprop-2-enyl]-propylamino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 15288637
[(7S)-7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-yl] trifluoromethanesulfonate
CID 10022617
(NE)-N-[1-[7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]butylidene]hydroxylamine
CID 139908769

Frequently Asked Questions

What is the IUPAC name of 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde?
The IUPAC name of 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde (CID 15230497) is 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde.
What is the SMILES notation for 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde?
The canonical SMILES for 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde is CCCN(CCC)C1CCc2cccc(C=O)c2C1.
What is the InChIKey of 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde?
The InChIKey is RIWWLJMHYNWZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-3-10-18(11-4-2)16-9-8-14-6-5-7-15(13-19)17(14)12-16/h5-7,13,16H,3-4,8-12H2,1-2H3.
What are the key properties of 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde?
7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde has a molecular weight of 259.39 g/mol, XLogP of 3.48, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde is sourced from PubChem (CID 15230497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).