3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine

C11H13FN4 — CID 126794017

IUPAC3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine
SMILESCC(Nc1ncccc1F)c1ccn(C)n1
InChIInChI=1S/C11H13FN4/c1-8(10-5-7-16(2)15-10)14-11-9(12)4-3-6-13-11/h3-8H,1-2H3,(H,13,14)
InChIKeyMOVFPIXJOHXRBY-UHFFFAOYSA-N
MW220.25 g/mol
LogP2.13
Rot. Bonds3

About 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine

3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine (PubChem CID 126794017) has the molecular formula C11H13FN4 and a molecular weight of 220.25 g/mol. Its IUPAC name is 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine
PubChem CID126794017
Molecular FormulaC11H13FN4
Molecular Weight220.25 g/mol
Exact Mass220.11
IUPAC Name3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine
SMILESCC(Nc1ncccc1F)c1ccn(C)n1
InChIInChI=1S/C11H13FN4/c1-8(10-5-7-16(2)15-10)14-11-9(12)4-3-6-13-11/h3-8H,1-2H3,(H,13,14)
InChIKeyMOVFPIXJOHXRBY-UHFFFAOYSA-N
XLogP2.13
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]pyridin-2-amine
CID 62733798
3-fluoro-N-propan-2-ylpyridin-2-amine
CID 62733783
N-[1-(1-methylpyrazol-3-yl)ethyl]-2,6-di(propan-2-yl)aniline
CID 146337355
3-[(3-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol
CID 130892998
N-[(1S)-1-(2,6-difluorophenyl)ethyl]-1-methylpyrazol-3-amine
CID 93329707
3-fluoro-N-(6-methylheptan-2-yl)pyridin-2-amine
CID 62732858
5-[[(1S)-1-(1-methylpyrazol-3-yl)ethyl]amino]pyridine-2-carbonitrile
CID 164632004
N-[(4-fluorophenyl)methyl]-1-(1-methylpyrazol-3-yl)ethanamine
CID 19625057
3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 62733426
2-[(3-fluoro-2-pyridinyl)amino]-1-piperidin-1-ylpropan-1-one
CID 112551708
2-methyl-1-(1-methylpyrazol-3-yl)propan-1-ol
CID 59693997
N-(1-ethoxy-3-methylbutan-2-yl)-3-fluoropyridin-2-amine
CID 103270021

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine?
The IUPAC name of 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine (CID 126794017) is 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine is CC(Nc1ncccc1F)c1ccn(C)n1.
What is the InChIKey of 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine?
The InChIKey is MOVFPIXJOHXRBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN4/c1-8(10-5-7-16(2)15-10)14-11-9(12)4-3-6-13-11/h3-8H,1-2H3,(H,13,14).
What are the key properties of 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine?
3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine has a molecular weight of 220.25 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[1-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 126794017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).