N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine

C15H17FN4 — CID 141014633

IUPACN-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine
SMILESFc1ccccc1N1CCC(Nc2ncccn2)CC1
InChIInChI=1S/C15H17FN4/c16-13-4-1-2-5-14(13)20-10-6-12(7-11-20)19-15-17-8-3-9-18-15/h1-5,8-9,12H,6-7,10-11H2,(H,17,18,19)
InChIKeyOREOSERTCQVROA-UHFFFAOYSA-N
MW272.33 g/mol
LogP2.70
Rot. Bonds3

About N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine

N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine (PubChem CID 141014633) has the molecular formula C15H17FN4 and a molecular weight of 272.33 g/mol. Its IUPAC name is N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine
PubChem CID141014633
Molecular FormulaC15H17FN4
Molecular Weight272.33 g/mol
Exact Mass272.14
IUPAC NameN-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine
SMILESFc1ccccc1N1CCC(Nc2ncccn2)CC1
InChIInChI=1S/C15H17FN4/c16-13-4-1-2-5-14(13)20-10-6-12(7-11-20)19-15-17-8-3-9-18-15/h1-5,8-9,12H,6-7,10-11H2,(H,17,18,19)
InChIKeyOREOSERTCQVROA-UHFFFAOYSA-N
XLogP2.70
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2-fluorophenyl)piperidin-3-yl]pyrimidin-2-amine
CID 133411829
N-cyclohexyl-1-(2-fluorophenyl)piperidin-4-amine
CID 66872138
methyl 2,3-difluoro-4-[4-(pyrimidin-2-ylamino)piperidin-1-yl]benzoate
CID 18469248
N-ethyl-1-(2-fluorophenyl)piperidin-4-amine
CID 43315313
1-(2-fluorophenyl)-N-[(1S)-1-pyridin-2-ylpropyl]piperidin-4-amine
CID 95188661
[2-(cyclopropylamino)-3-pyridinyl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 84574137
N-cyclopropyl-4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
CID 112907585
2-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidine;dihydrochloride
CID 174610452
amino 3-[[3-fluoro-4-[4-(pyrimidin-2-ylamino)piperidin-1-yl]benzoyl]amino]propanoate
CID 18469279
N-(1-iodopiperidin-4-yl)pyrimidin-2-amine
CID 164956065
1-(2-fluorophenyl)-4-methoxypiperidine
CID 15403847
3-amino-3-[[3-fluoro-4-[4-(pyrimidin-2-ylamino)piperidin-1-yl]benzoyl]amino]propanoic acid
CID 66672209

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine?
The IUPAC name of N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine (CID 141014633) is N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine.
What is the SMILES notation for N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine?
The canonical SMILES for N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine is Fc1ccccc1N1CCC(Nc2ncccn2)CC1.
What is the InChIKey of N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine?
The InChIKey is OREOSERTCQVROA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4/c16-13-4-1-2-5-14(13)20-10-6-12(7-11-20)19-15-17-8-3-9-18-15/h1-5,8-9,12H,6-7,10-11H2,(H,17,18,19).
What are the key properties of N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine?
N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine has a molecular weight of 272.33 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-fluorophenyl)piperidin-4-yl]pyrimidin-2-amine is sourced from PubChem (CID 141014633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).