6-methyl-1-naphthalen-1-ylheptan-2-ol

C18H24O — CID 105122822

IUPAC6-methyl-1-naphthalen-1-ylheptan-2-ol
SMILESCC(C)CCCC(O)Cc1cccc2ccccc12
InChIInChI=1S/C18H24O/c1-14(2)7-5-11-17(19)13-16-10-6-9-15-8-3-4-12-18(15)16/h3-4,6,8-10,12,14,17,19H,5,7,11,13H2,1-2H3
InChIKeyUEWPMXVHSHSJPJ-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.57
Rot. Bonds6

About 6-methyl-1-naphthalen-1-ylheptan-2-ol

6-methyl-1-naphthalen-1-ylheptan-2-ol (PubChem CID 105122822) has the molecular formula C18H24O and a molecular weight of 256.39 g/mol. Its IUPAC name is 6-methyl-1-naphthalen-1-ylheptan-2-ol.

Molecular Properties

Compound Name6-methyl-1-naphthalen-1-ylheptan-2-ol
PubChem CID105122822
Molecular FormulaC18H24O
Molecular Weight256.39 g/mol
Exact Mass256.18
IUPAC Name6-methyl-1-naphthalen-1-ylheptan-2-ol
SMILESCC(C)CCCC(O)Cc1cccc2ccccc12
InChIInChI=1S/C18H24O/c1-14(2)7-5-11-17(19)13-16-10-6-9-15-8-3-4-12-18(15)16/h3-4,6,8-10,12,14,17,19H,5,7,11,13H2,1-2H3
InChIKeyUEWPMXVHSHSJPJ-UHFFFAOYSA-N
XLogP4.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-naphthalen-1-ylnonan-2-ol
CID 19902465
5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol
CID 70057285
1-(7-methoxynaphthalen-1-yl)-6-methylheptan-2-ol
CID 83148133
5,5-dimethyl-1-naphthalen-1-ylhexan-2-ol
CID 105091563
1-(dimethylamino)-3-naphthalen-1-ylpropan-2-ol
CID 79088048
4-(diethylamino)-1-naphthalen-1-ylbutan-2-ol
CID 79086780
2-methyl-3-naphthalen-1-ylpropane-1,1-diol
CID 20647931
N,2-dimethyl-3-naphthalen-1-ylpropan-1-amine
CID 62528877
1-(2-methylhexadecyl)naphthalene
CID 139758361
(2R)-2-methyl-3-naphthalen-1-ylpropan-1-amine
CID 37134613
(2R)-N-methyl-1-naphthalen-1-ylpropan-2-amine
CID 142942326
2-(3-hydroxy-7-methyloctyl)phenol
CID 173316016

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-naphthalen-1-ylheptan-2-ol?
The IUPAC name of 6-methyl-1-naphthalen-1-ylheptan-2-ol (CID 105122822) is 6-methyl-1-naphthalen-1-ylheptan-2-ol.
What is the SMILES notation for 6-methyl-1-naphthalen-1-ylheptan-2-ol?
The canonical SMILES for 6-methyl-1-naphthalen-1-ylheptan-2-ol is CC(C)CCCC(O)Cc1cccc2ccccc12.
What is the InChIKey of 6-methyl-1-naphthalen-1-ylheptan-2-ol?
The InChIKey is UEWPMXVHSHSJPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O/c1-14(2)7-5-11-17(19)13-16-10-6-9-15-8-3-4-12-18(15)16/h3-4,6,8-10,12,14,17,19H,5,7,11,13H2,1-2H3.
What are the key properties of 6-methyl-1-naphthalen-1-ylheptan-2-ol?
6-methyl-1-naphthalen-1-ylheptan-2-ol has a molecular weight of 256.39 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-naphthalen-1-ylheptan-2-ol is sourced from PubChem (CID 105122822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).