4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol

C14H21NO — CID 79015530

IUPAC4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol
SMILESCC1CC(C)CN(Cc2ccc(O)cc2)C1
InChIInChI=1S/C14H21NO/c1-11-7-12(2)9-15(8-11)10-13-3-5-14(16)6-4-13/h3-6,11-12,16H,7-10H2,1-2H3
InChIKeyDBJWMKCXWKXRKT-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.87
Rot. Bonds2

About 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol

4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol (PubChem CID 79015530) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol.

Molecular Properties

Compound Name4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol
PubChem CID79015530
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol
SMILESCC1CC(C)CN(Cc2ccc(O)cc2)C1
InChIInChI=1S/C14H21NO/c1-11-7-12(2)9-15(8-11)10-13-3-5-14(16)6-4-13/h3-6,11-12,16H,7-10H2,1-2H3
InChIKeyDBJWMKCXWKXRKT-UHFFFAOYSA-N
XLogP2.87
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol
CID 82974406
N-[4-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]phenyl]acetamide
CID 26458271
4-[4-(3,5-dimethylpiperidin-1-yl)butyl]phenol
CID 82188002
6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol
CID 82975085
N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]-2-methylpropan-2-amine
CID 62424303
4-[(3,5-dimethylpiperidin-1-yl)methyl]-2-(trifluoromethyl)phenol
CID 82975162
2-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]-1,3-diethylguanidine
CID 110925686
cis-(1S,2R)-N-[[4-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]phenyl]methyl]-2-methylcyclopropane-1-carboxamide
CID 99845322
4-[(3,4-dimethylpiperazin-1-yl)methyl]phenol
CID 82973086
1-[(4-chlorophenyl)methyl]-5-methylpiperidin-3-amine
CID 79992959
(3S,5S)-1-[(3,4-dimethoxyphenyl)methyl]-3,5-dimethylpiperidine
CID 784275
3-chloro-2-[(3,5-dimethylpiperidin-1-yl)methyl]phenol
CID 82974860

Frequently Asked Questions

What is the IUPAC name of 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol?
The IUPAC name of 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol (CID 79015530) is 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol.
What is the SMILES notation for 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol?
The canonical SMILES for 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol is CC1CC(C)CN(Cc2ccc(O)cc2)C1.
What is the InChIKey of 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol?
The InChIKey is DBJWMKCXWKXRKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11-7-12(2)9-15(8-11)10-13-3-5-14(16)6-4-13/h3-6,11-12,16H,7-10H2,1-2H3.
What are the key properties of 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol?
4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol has a molecular weight of 219.33 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,5-dimethylpiperidin-1-yl)methyl]phenol is sourced from PubChem (CID 79015530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).