5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine

C12H18FN3 — CID 61474336

IUPAC5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine
SMILESCC(CN1CCCC1)Nc1ccc(F)cn1
InChIInChI=1S/C12H18FN3/c1-10(9-16-6-2-3-7-16)15-12-5-4-11(13)8-14-12/h4-5,8,10H,2-3,6-7,9H2,1H3,(H,14,15)
InChIKeyPBCMYYSEBYTIMR-UHFFFAOYSA-N
MW223.30 g/mol
LogP2.12
Rot. Bonds4

About 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine

5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine (PubChem CID 61474336) has the molecular formula C12H18FN3 and a molecular weight of 223.30 g/mol. Its IUPAC name is 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine
PubChem CID61474336
Molecular FormulaC12H18FN3
Molecular Weight223.30 g/mol
Exact Mass223.15
IUPAC Name5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine
SMILESCC(CN1CCCC1)Nc1ccc(F)cn1
InChIInChI=1S/C12H18FN3/c1-10(9-16-6-2-3-7-16)15-12-5-4-11(13)8-14-12/h4-5,8,10H,2-3,6-7,9H2,1H3,(H,14,15)
InChIKeyPBCMYYSEBYTIMR-UHFFFAOYSA-N
XLogP2.12
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-fluoro-2-pyridinyl)-N-(1-pyrrolidin-1-ylpropan-2-yl)propan-1-amine
CID 112583060
6-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridazin-3-amine
CID 61474335
1-(5-fluoro-2-pyridinyl)-2-methyl-3-piperidin-1-ylpropan-1-amine
CID 112586259
6-hydrazinyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrazin-2-amine
CID 80897850
2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3-thiazole-2,5-diamine
CID 102767910
3-bromo-4-methyl-N-(1-piperidin-1-ylpropan-2-yl)pyridin-2-amine
CID 106875617
N-(3-ethylpentan-2-yl)-5-fluoropyridin-2-amine
CID 63836752
1-(5-fluoro-2-pyridinyl)-2-methyl-N-propyl-3-pyrrolidin-1-ylpropan-1-amine
CID 115941126
1-[(2S)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-3-(5-fluoro-2-pyridinyl)urea
CID 99595837
N-[1-(4-methylpiperazin-1-yl)propan-2-yl]-5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 133293070
5-bromo-N-(1-pyrrolidin-1-ylpropan-2-yl)-3-(trifluoromethyl)pyridin-2-amine
CID 106796067
methyl 6-(1-pyrrolidin-1-ylpropan-2-ylamino)pyridazine-3-carboxylate
CID 61222218

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine?
The IUPAC name of 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine (CID 61474336) is 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine?
The canonical SMILES for 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine is CC(CN1CCCC1)Nc1ccc(F)cn1.
What is the InChIKey of 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine?
The InChIKey is PBCMYYSEBYTIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FN3/c1-10(9-16-6-2-3-7-16)15-12-5-4-11(13)8-14-12/h4-5,8,10H,2-3,6-7,9H2,1H3,(H,14,15).
What are the key properties of 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine?
5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine has a molecular weight of 223.30 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine is sourced from PubChem (CID 61474336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).