5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine

C9H12FN3 — CID 58254860

IUPAC5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
SMILESFc1ccc(N[C@@H]2CCNC2)nc1
InChIInChI=1S/C9H12FN3/c10-7-1-2-9(12-5-7)13-8-3-4-11-6-8/h1-2,5,8,11H,3-4,6H2,(H,12,13)/t8-/m1/s1
InChIKeyGSZBTTYMTSOKDD-MRVPVSSYSA-N
MW181.21 g/mol
LogP0.99
Rot. Bonds2

About 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine

5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine (PubChem CID 58254860) has the molecular formula C9H12FN3 and a molecular weight of 181.21 g/mol. Its IUPAC name is 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
PubChem CID58254860
Molecular FormulaC9H12FN3
Molecular Weight181.21 g/mol
Exact Mass181.10
IUPAC Name5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
SMILESFc1ccc(N[C@@H]2CCNC2)nc1
InChIInChI=1S/C9H12FN3/c10-7-1-2-9(12-5-7)13-8-3-4-11-6-8/h1-2,5,8,11H,3-4,6H2,(H,12,13)/t8-/m1/s1
InChIKeyGSZBTTYMTSOKDD-MRVPVSSYSA-N
XLogP0.99
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-5-fluoropyridin-2-amine
CID 61313330
5-methyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 68833864
5-bromo-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71636366
N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine
CID 130791657
4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine
CID 62312959
N-pyrrolidin-3-ylpyridin-2-amine
CID 19814840
N,N-dimethyl-6-(pyrrolidin-3-ylamino)pyridine-3-sulfonamide
CID 103341109
N-(2,5-difluorophenyl)pyrrolidin-3-amine
CID 79737094
N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine
CID 114280857
6,7-difluoro-N-[(3R)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 67578682
N-(2,4-difluorophenyl)pyrrolidin-3-amine
CID 66545630
5-fluoro-N-(3,3,5,5-tetramethylcyclohexyl)pyridin-2-amine
CID 103967192

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine?
The IUPAC name of 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine (CID 58254860) is 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine.
What is the SMILES notation for 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine?
The canonical SMILES for 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine is Fc1ccc(N[C@@H]2CCNC2)nc1.
What is the InChIKey of 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine?
The InChIKey is GSZBTTYMTSOKDD-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H12FN3/c10-7-1-2-9(12-5-7)13-8-3-4-11-6-8/h1-2,5,8,11H,3-4,6H2,(H,12,13)/t8-/m1/s1.
What are the key properties of 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine?
5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine has a molecular weight of 181.21 g/mol, XLogP of 0.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine is sourced from PubChem (CID 58254860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).