7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol

C14H21NO — CID 10704110

IUPAC7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESCCCN(C)C1CCc2ccc(O)cc2C1
InChIInChI=1S/C14H21NO/c1-3-8-15(2)13-6-4-11-5-7-14(16)10-12(11)9-13/h5,7,10,13,16H,3-4,6,8-9H2,1-2H3
InChIKeyUKKJJXAEHLPZSM-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.59
Rot. Bonds3

About 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol

7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol (PubChem CID 10704110) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
PubChem CID10704110
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESCCCN(C)C1CCc2ccc(O)cc2C1
InChIInChI=1S/C14H21NO/c1-3-8-15(2)13-6-4-11-5-7-14(16)10-12(11)9-13/h5,7,10,13,16H,3-4,6,8-9H2,1-2H3
InChIKeyUKKJJXAEHLPZSM-UHFFFAOYSA-N
XLogP2.59
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The IUPAC name of 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol (CID 10704110) is 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol.
What is the SMILES notation for 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The canonical SMILES for 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol is CCCN(C)C1CCc2ccc(O)cc2C1.
What is the InChIKey of 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The InChIKey is UKKJJXAEHLPZSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-3-8-15(2)13-6-4-11-5-7-14(16)10-12(11)9-13/h5,7,10,13,16H,3-4,6,8-9H2,1-2H3.
What are the key properties of 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol?
7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol has a molecular weight of 219.33 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[methyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 10704110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).