3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine

C9H12FN3 — CID 62732869

IUPAC3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine
SMILESFc1cccnc1NC1CCNC1
InChIInChI=1S/C9H12FN3/c10-8-2-1-4-12-9(8)13-7-3-5-11-6-7/h1-2,4,7,11H,3,5-6H2,(H,12,13)
InChIKeySLCJCEXRTCRMAB-UHFFFAOYSA-N
MW181.21 g/mol
LogP0.99
Rot. Bonds2

About 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine

3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine (PubChem CID 62732869) has the molecular formula C9H12FN3 and a molecular weight of 181.21 g/mol. Its IUPAC name is 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine
PubChem CID62732869
Molecular FormulaC9H12FN3
Molecular Weight181.21 g/mol
Exact Mass181.10
IUPAC Name3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine
SMILESFc1cccnc1NC1CCNC1
InChIInChI=1S/C9H12FN3/c10-8-2-1-4-12-9(8)13-7-3-5-11-6-7/h1-2,4,7,11H,3,5-6H2,(H,12,13)
InChIKeySLCJCEXRTCRMAB-UHFFFAOYSA-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

3-nitro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71635600
(1R,5S)-N-(3-fluoro-2-pyridinyl)-3-azabicyclo[3.1.0]hexan-6-amine
CID 130719347
N-piperidin-3-yl-3-(trifluoromethyl)pyridin-2-amine
CID 63319382
N,N-dimethyl-2-[[(3R)-pyrrolidin-3-yl]amino]pyridine-3-carboxamide
CID 122441446
N-pyrrolidin-3-ylpyridin-2-amine
CID 19814840
3-bromo-4-methyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 106876094
3-fluoro-N-(piperidin-4-ylmethyl)pyridin-2-amine;dihydrochloride
CID 162422902
N-(1,1-dioxothietan-3-yl)-3-fluoropyridin-2-amine
CID 130949037
8-fluoro-N-[(3R)-pyrrolidin-3-yl]quinazolin-2-amine
CID 148694328
N-[(3S)-pyrrolidin-3-yl]furo[3,2-c]pyridin-4-amine
CID 129414245
3-fluoro-N-(2-piperidin-3-ylethyl)pyridin-2-amine
CID 63629585
3-nitro-N-[(3S)-piperidin-3-yl]pyridin-2-amine;hydrochloride
CID 71635602

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine?
The IUPAC name of 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine (CID 62732869) is 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine.
What is the SMILES notation for 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine?
The canonical SMILES for 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine is Fc1cccnc1NC1CCNC1.
What is the InChIKey of 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine?
The InChIKey is SLCJCEXRTCRMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FN3/c10-8-2-1-4-12-9(8)13-7-3-5-11-6-7/h1-2,4,7,11H,3,5-6H2,(H,12,13).
What are the key properties of 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine?
3-fluoro-N-pyrrolidin-3-ylpyridin-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 3-fluoro-N-pyrrolidin-3-ylpyridin-2-amine is sourced from PubChem (CID 62732869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).