[4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol

C19H23FN2O — CID 110009486

IUPAC[4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol
SMILESOCc1ccc(CN2CCC(Nc3ccccc3F)CC2)cc1
InChIInChI=1S/C19H23FN2O/c20-18-3-1-2-4-19(18)21-17-9-11-22(12-10-17)13-15-5-7-16(14-23)8-6-15/h1-8,17,21,23H,9-14H2
InChIKeyYGRCYWFTTCYYOH-UHFFFAOYSA-N
MW314.40 g/mol
LogP3.39
Rot. Bonds5

About [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol

[4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol (PubChem CID 110009486) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol
PubChem CID110009486
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name[4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol
SMILESOCc1ccc(CN2CCC(Nc3ccccc3F)CC2)cc1
InChIInChI=1S/C19H23FN2O/c20-18-3-1-2-4-19(18)21-17-9-11-22(12-10-17)13-15-5-7-16(14-23)8-6-15/h1-8,17,21,23H,9-14H2
InChIKeyYGRCYWFTTCYYOH-UHFFFAOYSA-N
XLogP3.39
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [4-[[4-(2-fluoroanilino)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-[4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]acetamide
CID 75515001
4-[4-(2-fluoroanilino)piperidin-1-yl]butan-1-ol
CID 111496659
3-[(1-benzylpiperidin-4-yl)amino]-4-fluorobenzonitrile
CID 21015031
1-[2-[(1-benzylpiperidin-4-yl)amino]anilino]-3-chloropropan-2-ol
CID 168639852
1-[(2,5-dimethoxyphenyl)methyl]-N-(2-fluorophenyl)piperidin-4-amine
CID 7357181
1-N-(1-benzylpiperidin-4-yl)-4-fluorobenzene-1,2-diamine
CID 21193065
[4-[[4-(2,4-difluorophenoxy)piperidin-1-yl]methyl]phenyl]methanol
CID 110008205
2-[(1-benzylpiperidin-4-yl)amino]-1-(2,6-difluorophenyl)ethanol
CID 110896900
[4-[(4-methoxypiperidin-1-yl)methyl]phenyl]methanol
CID 112631146
2-[(1-benzylpiperidin-4-yl)amino]-4-bromo-6-fluorobenzamide
CID 133423368
3-[4-(2-fluoroanilino)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 71986668
N-[1-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-yl]-2-methylbenzamide
CID 110009371

Frequently Asked Questions

What is the IUPAC name of [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol?
The IUPAC name of [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol (CID 110009486) is [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol.
What is the SMILES notation for [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol?
The canonical SMILES for [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol is OCc1ccc(CN2CCC(Nc3ccccc3F)CC2)cc1.
What is the InChIKey of [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol?
The InChIKey is YGRCYWFTTCYYOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O/c20-18-3-1-2-4-19(18)21-17-9-11-22(12-10-17)13-15-5-7-16(14-23)8-6-15/h1-8,17,21,23H,9-14H2.
What are the key properties of [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol?
[4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol has a molecular weight of 314.40 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[4-(2-fluoroanilino)piperidin-1-yl]methyl]phenyl]methanol is sourced from PubChem (CID 110009486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).