6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine

C15H16FN3 — CID 146380890

IUPAC6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine
SMILESNc1ccc(N2CCC[C@H]2c2cccc(F)c2)nc1
InChIInChI=1S/C15H16FN3/c16-12-4-1-3-11(9-12)14-5-2-8-19(14)15-7-6-13(17)10-18-15/h1,3-4,6-7,9-10,14H,2,5,8,17H2/t14-/m0/s1
InChIKeyKCASNCSJBINIFI-AWEZNQCLSA-N
MW257.31 g/mol
LogP3.14
Rot. Bonds2

About 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine

6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine (PubChem CID 146380890) has the molecular formula C15H16FN3 and a molecular weight of 257.31 g/mol. Its IUPAC name is 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine
PubChem CID146380890
Molecular FormulaC15H16FN3
Molecular Weight257.31 g/mol
Exact Mass257.13
IUPAC Name6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine
SMILESNc1ccc(N2CCC[C@H]2c2cccc(F)c2)nc1
InChIInChI=1S/C15H16FN3/c16-12-4-1-3-11(9-12)14-5-2-8-19(14)15-7-6-13(17)10-18-15/h1,3-4,6-7,9-10,14H,2,5,8,17H2/t14-/m0/s1
InChIKeyKCASNCSJBINIFI-AWEZNQCLSA-N
XLogP3.14
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine
CID 146388088
2-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyrimidin-5-amine
CID 146380893
5-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
CID 67329531
3-(3-fluorophenyl)-6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazine
CID 162486125
6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazine-3-carboxylic acid
CID 66684546
5-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyrimidine-2-carboxylic acid
CID 146380824
2-[2-(3-fluorophenyl)pyrrolidin-1-yl]pyrimidine-5-carboxylic acid
CID 156774048
6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]-N-[(2-methylpropan-2-yl)oxy]imidazo[1,2-b]pyridazine-3-carboxamide
CID 87106081
5-[(2S)-2-(3,5-difluorophenyl)pyrrolidin-1-yl]pyrazin-2-amine
CID 146380808
6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazine-3-carbonyl chloride
CID 86663106
6-[6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]pyridine-2-carboxamide
CID 44520270
3-[6-[2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]quinoline
CID 58335793

Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine?
The IUPAC name of 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine (CID 146380890) is 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine.
What is the SMILES notation for 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine?
The canonical SMILES for 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine is Nc1ccc(N2CCC[C@H]2c2cccc(F)c2)nc1.
What is the InChIKey of 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine?
The InChIKey is KCASNCSJBINIFI-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H16FN3/c16-12-4-1-3-11(9-12)14-5-2-8-19(14)15-7-6-13(17)10-18-15/h1,3-4,6-7,9-10,14H,2,5,8,17H2/t14-/m0/s1.
What are the key properties of 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine?
6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine has a molecular weight of 257.31 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-2-(3-fluorophenyl)pyrrolidin-1-yl]pyridin-3-amine is sourced from PubChem (CID 146380890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).