2-naphthalen-1-ylhexan-1-ol

C16H20O — CID 57029231

IUPAC2-naphthalen-1-ylhexan-1-ol
SMILESCCCCC(CO)c1cccc2ccccc12
InChIInChI=1S/C16H20O/c1-2-3-7-14(12-17)16-11-6-9-13-8-4-5-10-15(13)16/h4-6,8-11,14,17H,2-3,7,12H2,1H3
InChIKeySDNTWFSBBNVLFD-UHFFFAOYSA-N
MW228.34 g/mol
LogP4.11
Rot. Bonds5

About 2-naphthalen-1-ylhexan-1-ol

2-naphthalen-1-ylhexan-1-ol (PubChem CID 57029231) has the molecular formula C16H20O and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-naphthalen-1-ylhexan-1-ol.

Molecular Properties

Compound Name2-naphthalen-1-ylhexan-1-ol
PubChem CID57029231
Molecular FormulaC16H20O
Molecular Weight228.34 g/mol
Exact Mass228.15
IUPAC Name2-naphthalen-1-ylhexan-1-ol
SMILESCCCCC(CO)c1cccc2ccccc12
InChIInChI=1S/C16H20O/c1-2-3-7-14(12-17)16-11-6-9-13-8-4-5-10-15(13)16/h4-6,8-11,14,17H,2-3,7,12H2,1H3
InChIKeySDNTWFSBBNVLFD-UHFFFAOYSA-N
XLogP4.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-decan-5-ylnaphthalene
CID 14029915
1-tetracosan-9-ylnaphthalene
CID 175897855
1-hexadecan-6-ylnaphthalene
CID 14029925
3-naphthalen-1-ylheptan-1-amine
CID 142028314
1-octacosan-4-ylnaphthalene
CID 54149804
4-(diethylamino)-2-naphthalen-1-ylbutan-1-ol
CID 15595616
5-naphthalen-1-ylheptadecan-2-one
CID 142778100
1-dodec-9-en-5-ylnaphthalene
CID 173291784
N-methyl-1-naphthalen-1-ylpentan-1-amine
CID 55103784
2-naphthalen-1-ylhexanoyl chloride
CID 131880950
(1R)-1-naphthalen-1-ylhexan-1-amine
CID 171212033
1-tridecan-7-ylanthracene
CID 150514951

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-ylhexan-1-ol?
The IUPAC name of 2-naphthalen-1-ylhexan-1-ol (CID 57029231) is 2-naphthalen-1-ylhexan-1-ol.
What is the SMILES notation for 2-naphthalen-1-ylhexan-1-ol?
The canonical SMILES for 2-naphthalen-1-ylhexan-1-ol is CCCCC(CO)c1cccc2ccccc12.
What is the InChIKey of 2-naphthalen-1-ylhexan-1-ol?
The InChIKey is SDNTWFSBBNVLFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O/c1-2-3-7-14(12-17)16-11-6-9-13-8-4-5-10-15(13)16/h4-6,8-11,14,17H,2-3,7,12H2,1H3.
What are the key properties of 2-naphthalen-1-ylhexan-1-ol?
2-naphthalen-1-ylhexan-1-ol has a molecular weight of 228.34 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-ylhexan-1-ol is sourced from PubChem (CID 57029231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).