[4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol

C18H30N2O — CID 110009724

IUPAC[4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol
SMILESCN(C)CCCC1CCN(Cc2ccc(CO)cc2)CC1
InChIInChI=1S/C18H30N2O/c1-19(2)11-3-4-16-9-12-20(13-10-16)14-17-5-7-18(15-21)8-6-17/h5-8,16,21H,3-4,9-15H2,1-2H3
InChIKeyPBYIZRZSRXXKKK-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.73
Rot. Bonds7

About [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol

[4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol (PubChem CID 110009724) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol
PubChem CID110009724
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name[4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol
SMILESCN(C)CCCC1CCN(Cc2ccc(CO)cc2)CC1
InChIInChI=1S/C18H30N2O/c1-19(2)11-3-4-16-9-12-20(13-10-16)14-17-5-7-18(15-21)8-6-17/h5-8,16,21H,3-4,9-15H2,1-2H3
InChIKeyPBYIZRZSRXXKKK-UHFFFAOYSA-N
XLogP2.73
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(dimethylamino)ethyl]-1-[[4-(hydroxymethyl)phenyl]methyl]piperidine-4-carboxamide
CID 110009397
[4-[(3-propylpyrrolidin-1-yl)methyl]phenyl]methanol
CID 113356734
[4-[(4-ethylazepan-1-yl)methyl]phenyl]methanol
CID 112631282
[4-[(4-methoxypiperidin-1-yl)methyl]phenyl]methanol
CID 112631146
2-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]ethanol
CID 10562587
4-(1-benzylpiperidin-4-yl)-N,N-diethylbutan-1-amine;ethane
CID 142036971
3-[1-(2-aminoethyl)piperidin-4-yl]-N,N-dimethylpropan-1-amine
CID 19845999
1-[1-[[4-(aminomethyl)phenyl]methyl]piperidin-4-yl]-N,N-dimethylmethanamine
CID 54986245
2-[1-[(2,6-dichlorophenyl)methyl]piperidin-4-yl]-N,N-dimethylethanamine
CID 60543116
3-[4-(1-benzylpiperidin-4-yl)piperazin-1-yl]-N,N-dimethylpropan-1-amine
CID 21109896
2-[4-[[4-[(dimethylamino)methyl]piperidin-1-yl]methyl]phenyl]acetic acid
CID 105345835
4-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-N,N-dimethylbenzamide
CID 111434309

Frequently Asked Questions

What is the IUPAC name of [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol?
The IUPAC name of [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol (CID 110009724) is [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol.
What is the SMILES notation for [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol?
The canonical SMILES for [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol is CN(C)CCCC1CCN(Cc2ccc(CO)cc2)CC1.
What is the InChIKey of [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol?
The InChIKey is PBYIZRZSRXXKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-19(2)11-3-4-16-9-12-20(13-10-16)14-17-5-7-18(15-21)8-6-17/h5-8,16,21H,3-4,9-15H2,1-2H3.
What are the key properties of [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol?
[4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol has a molecular weight of 290.45 g/mol, XLogP of 2.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol is sourced from PubChem (CID 110009724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).