4-(piperidin-4-ylmethyl)phenol

C12H17NO — CID 17039495

IUPAC4-(piperidin-4-ylmethyl)phenol
SMILESOc1ccc(CC2CCNCC2)cc1
InChIInChI=1S/C12H17NO/c14-12-3-1-10(2-4-12)9-11-5-7-13-8-6-11/h1-4,11,13-14H,5-9H2
InChIKeyGHBKSHYCSYZXOW-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.93
Rot. Bonds2

About 4-(piperidin-4-ylmethyl)phenol

4-(piperidin-4-ylmethyl)phenol (PubChem CID 17039495) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 4-(piperidin-4-ylmethyl)phenol.

Molecular Properties

Compound Name4-(piperidin-4-ylmethyl)phenol
PubChem CID17039495
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name4-(piperidin-4-ylmethyl)phenol
SMILESOc1ccc(CC2CCNCC2)cc1
InChIInChI=1S/C12H17NO/c14-12-3-1-10(2-4-12)9-11-5-7-13-8-6-11/h1-4,11,13-14H,5-9H2
InChIKeyGHBKSHYCSYZXOW-UHFFFAOYSA-N
XLogP1.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(azepan-4-ylmethyl)phenol
CID 83261604
4-[[4-[(4-hydroxyphenyl)methyl]cyclohexyl]methyl]phenol
CID 86168962
4-[[4-(fluoromethyl)phenyl]methyl]piperidine
CID 84675538
4-[[4-(methoxymethyl)phenyl]methyl]piperidine
CID 84786985
4-(piperidin-4-ylmethyl)benzonitrile
CID 11644367
3-ethyl-5-(piperidin-4-ylmethyl)phenol
CID 117312985
4-[[4-(difluoromethyl)phenyl]methyl]piperidine
CID 84689877
N,N-dimethyl-4-(piperidin-4-ylmethyl)aniline
CID 15296936
4-[2-(azepan-4-yl)ethyl]phenol
CID 84685003
2-amino-4-(piperidin-4-ylmethyl)phenol
CID 117117856
4-[[4-(trifluoromethoxy)phenyl]methyl]piperidine;4-[4-[[4-(trifluoromethoxy)phenyl]methyl]piperidin-1-yl]phenol
CID 158919726
4-[(4-iodophenyl)methyl]azepane
CID 83262135

Frequently Asked Questions

What is the IUPAC name of 4-(piperidin-4-ylmethyl)phenol?
The IUPAC name of 4-(piperidin-4-ylmethyl)phenol (CID 17039495) is 4-(piperidin-4-ylmethyl)phenol.
What is the SMILES notation for 4-(piperidin-4-ylmethyl)phenol?
The canonical SMILES for 4-(piperidin-4-ylmethyl)phenol is Oc1ccc(CC2CCNCC2)cc1.
What is the InChIKey of 4-(piperidin-4-ylmethyl)phenol?
The InChIKey is GHBKSHYCSYZXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c14-12-3-1-10(2-4-12)9-11-5-7-13-8-6-11/h1-4,11,13-14H,5-9H2.
What are the key properties of 4-(piperidin-4-ylmethyl)phenol?
4-(piperidin-4-ylmethyl)phenol has a molecular weight of 191.27 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperidin-4-ylmethyl)phenol is sourced from PubChem (CID 17039495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).