5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine

C15H17FN4 — CID 162748564

IUPAC5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine
SMILESFc1cnc(Nc2ccccc2)nc1C1CCNCC1
InChIInChI=1S/C15H17FN4/c16-13-10-18-15(19-12-4-2-1-3-5-12)20-14(13)11-6-8-17-9-7-11/h1-5,10-11,17H,6-9H2,(H,18,19,20)
InChIKeyWCLASYSSVDCAAQ-UHFFFAOYSA-N
MW272.33 g/mol
LogP2.83
Rot. Bonds3

About 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine

5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine (PubChem CID 162748564) has the molecular formula C15H17FN4 and a molecular weight of 272.33 g/mol. Its IUPAC name is 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine
PubChem CID162748564
Molecular FormulaC15H17FN4
Molecular Weight272.33 g/mol
Exact Mass272.14
IUPAC Name5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine
SMILESFc1cnc(Nc2ccccc2)nc1C1CCNCC1
InChIInChI=1S/C15H17FN4/c16-13-10-18-15(19-12-4-2-1-3-5-12)20-14(13)11-6-8-17-9-7-11/h1-5,10-11,17H,6-9H2,(H,18,19,20)
InChIKeyWCLASYSSVDCAAQ-UHFFFAOYSA-N
XLogP2.83
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-fluoro-2-N-phenyl-4-N-piperidin-3-ylpyrimidine-2,4-diamine
CID 71014823
2-chloro-5-fluoro-4-piperidin-4-ylpyrimidine
CID 170985227
5-fluoro-N-phenyl-4-(2-phenylethyl)pyrimidin-2-amine
CID 66764541
N-phenyl-3,5-diazatricyclo[6.2.1.02,7]undeca-2,4,6-trien-4-amine
CID 104609507
5-fluoro-2-N,4-N-bis(3-phenylphenyl)pyrimidine-2,4-diamine
CID 66759549
5-fluoro-4-methoxy-N-phenylpyrimidin-2-amine
CID 121221051
5-fluoro-2-N,4-N-bis(4-fluorophenyl)pyrimidine-2,4-diamine
CID 954308
N-phenyl-5-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 59276461
2-N,4-N-bis(3-aminophenyl)-5-fluoropyrimidine-2,4-diamine;hydron
CID 69247498
N-(3-fluoro-4-piperidin-4-ylphenyl)-4-(3-phenyl-1,2-oxazolidin-2-yl)-5-(trifluoromethyl)pyrimidin-2-amine
CID 175754141
6-fluoro-2-N-phenylpyrido[2,3-d]pyrimidine-2,7-diamine
CID 141037386
4-[2-[2-(2-aminoprop-2-enyl)phenyl]ethyl]-N-(4-piperidin-4-ylphenyl)-5-(trifluoromethyl)pyrimidin-2-amine
CID 135292954

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine?
The IUPAC name of 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine (CID 162748564) is 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine.
What is the SMILES notation for 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine?
The canonical SMILES for 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine is Fc1cnc(Nc2ccccc2)nc1C1CCNCC1.
What is the InChIKey of 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine?
The InChIKey is WCLASYSSVDCAAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4/c16-13-10-18-15(19-12-4-2-1-3-5-12)20-14(13)11-6-8-17-9-7-11/h1-5,10-11,17H,6-9H2,(H,18,19,20).
What are the key properties of 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine?
5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine has a molecular weight of 272.33 g/mol, XLogP of 2.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-phenyl-4-piperidin-4-ylpyrimidin-2-amine is sourced from PubChem (CID 162748564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).