2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol

C16H25NO — CID 154487648

IUPAC2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCCCN(CCC)c1ccc2c(c1O)CCCC2
InChIInChI=1S/C16H25NO/c1-3-11-17(12-4-2)15-10-9-13-7-5-6-8-14(13)16(15)18/h9-10,18H,3-8,11-12H2,1-2H3
InChIKeyQDHMOIBCBVLDPU-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.90
Rot. Bonds5

About 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol

2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 154487648) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID154487648
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCCCN(CCC)c1ccc2c(c1O)CCCC2
InChIInChI=1S/C16H25NO/c1-3-11-17(12-4-2)15-10-9-13-7-5-6-8-14(13)16(15)18/h9-10,18H,3-8,11-12H2,1-2H3
InChIKeyQDHMOIBCBVLDPU-UHFFFAOYSA-N
XLogP3.90
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol (CID 154487648) is 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol is CCCN(CCC)c1ccc2c(c1O)CCCC2.
What is the InChIKey of 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is QDHMOIBCBVLDPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-3-11-17(12-4-2)15-10-9-13-7-5-6-8-14(13)16(15)18/h9-10,18H,3-8,11-12H2,1-2H3.
What are the key properties of 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol?
2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 247.38 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 154487648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).