N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine

C17H20FN3 — CID 95825266

IUPACN-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine
SMILESFc1cccc(CNc2ccnc(C3CCNCC3)c2)c1
InChIInChI=1S/C17H20FN3/c18-15-3-1-2-13(10-15)12-21-16-6-9-20-17(11-16)14-4-7-19-8-5-14/h1-3,6,9-11,14,19H,4-5,7-8,12H2,(H,20,21)
InChIKeyFATYFTSGHCWOCP-UHFFFAOYSA-N
MW285.37 g/mol
LogP3.30
Rot. Bonds4

About N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine

N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine (PubChem CID 95825266) has the molecular formula C17H20FN3 and a molecular weight of 285.37 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine
PubChem CID95825266
Molecular FormulaC17H20FN3
Molecular Weight285.37 g/mol
Exact Mass285.16
IUPAC NameN-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine
SMILESFc1cccc(CNc2ccnc(C3CCNCC3)c2)c1
InChIInChI=1S/C17H20FN3/c18-15-3-1-2-13(10-15)12-21-16-6-9-20-17(11-16)14-4-7-19-8-5-14/h1-3,6,9-11,14,19H,4-5,7-8,12H2,(H,20,21)
InChIKeyFATYFTSGHCWOCP-UHFFFAOYSA-N
XLogP3.30
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenylethyl)-2-piperidin-4-ylpyridin-4-amine
CID 95825111
2-piperidin-4-yl-N-(2-pyridin-2-ylethyl)pyridin-4-amine
CID 95825383
4-[(4-fluorophenyl)methyl]-2-piperidin-4-ylpyridine
CID 95844382
3-[[4-[(3-fluorophenyl)methylamino]phenyl]methylamino]pyrrolidin-2-one
CID 54212623
N-[(3-fluorophenyl)methyl]-3-iodoaniline
CID 28879212
5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole
CID 93202830
N-[(3,5-difluorophenyl)methyl]-4-fluoro-3-(2-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridin-4-yl)aniline
CID 90419979
(5S)-N-[(3-fluorophenyl)methyl]-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepin-7-amine;hydrochloride
CID 69246410
2-piperidin-4-yl-4-(trifluoromethyl)pyridine
CID 18413985
N-[(3-fluorophenyl)methyl]-6-[[(3S)-pyrrolidin-3-yl]methyl]pyridin-2-amine
CID 95826474
N-[2-(3-fluorophenyl)ethyl]-4-[3-(2-piperidin-4-ylethyl)phenyl]pyrimidin-2-amine
CID 58603492
4-bromo-2-piperidin-4-ylpyridine
CID 76848192

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine?
The IUPAC name of N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine (CID 95825266) is N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine is Fc1cccc(CNc2ccnc(C3CCNCC3)c2)c1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine?
The InChIKey is FATYFTSGHCWOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FN3/c18-15-3-1-2-13(10-15)12-21-16-6-9-20-17(11-16)14-4-7-19-8-5-14/h1-3,6,9-11,14,19H,4-5,7-8,12H2,(H,20,21).
What are the key properties of N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine?
N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine has a molecular weight of 285.37 g/mol, XLogP of 3.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine is sourced from PubChem (CID 95825266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).