(6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol

C17H21NO — CID 142617854

IUPAC(6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol
SMILESCc1ccc2c(CO)ccc(N3CCCCC3)c2c1
InChIInChI=1S/C17H21NO/c1-13-5-7-15-14(12-19)6-8-17(16(15)11-13)18-9-3-2-4-10-18/h5-8,11,19H,2-4,9-10,12H2,1H3
InChIKeyABONMAHAJRTBSC-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.63
Rot. Bonds2

About (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol

(6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol (PubChem CID 142617854) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol.

Molecular Properties

Compound Name(6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol
PubChem CID142617854
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name(6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol
SMILESCc1ccc2c(CO)ccc(N3CCCCC3)c2c1
InChIInChI=1S/C17H21NO/c1-13-5-7-15-14(12-19)6-8-17(16(15)11-13)18-9-3-2-4-10-18/h5-8,11,19H,2-4,9-10,12H2,1H3
InChIKeyABONMAHAJRTBSC-UHFFFAOYSA-N
XLogP3.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

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Related Compounds

2-(5-methyl-2-piperidin-1-ylphenyl)ethanol
CID 117313218
1-(2-ethyl-4-methylphenyl)piperidine
CID 90278771
1-(2-ethyl-5-methylphenyl)pyrrolidine
CID 89060262
2-(5-methyl-2-piperidin-1-ylphenyl)propan-1-ol
CID 117339041
1-(5-methyl-2-piperidin-1-ylphenyl)propan-2-ol
CID 117339203
1-(5-methyl-2-pyrrolidin-1-ylphenyl)propan-2-one
CID 117309875
1-(4-methyl-2-phenylphenyl)piperidine
CID 57106520
[4-(azepan-1-yl)-2-methylphenyl]methanol
CID 62136548
(5-amino-2-piperidin-1-ylphenyl)methanol
CID 118164480
2-(5-methyl-2-piperidin-1-ylphenyl)propan-2-ol
CID 117339104
4-(azepan-1-yl)-6-methylquinoline
CID 133466822
1-(5-methyl-2-piperidin-1-ylphenyl)ethanone
CID 117309750

Frequently Asked Questions

What is the IUPAC name of (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol?
The IUPAC name of (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol (CID 142617854) is (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol.
What is the SMILES notation for (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol?
The canonical SMILES for (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol is Cc1ccc2c(CO)ccc(N3CCCCC3)c2c1.
What is the InChIKey of (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol?
The InChIKey is ABONMAHAJRTBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-13-5-7-15-14(12-19)6-8-17(16(15)11-13)18-9-3-2-4-10-18/h5-8,11,19H,2-4,9-10,12H2,1H3.
What are the key properties of (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol?
(6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol has a molecular weight of 255.36 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-4-piperidin-1-ylnaphthalen-1-yl)methanol is sourced from PubChem (CID 142617854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).