N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine

C14H13FN4 — CID 118576981

IUPACN-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine
SMILESFCCNc1ccc(-n2ccc3ccncc32)nc1
InChIInChI=1S/C14H13FN4/c15-5-7-17-12-1-2-14(18-9-12)19-8-4-11-3-6-16-10-13(11)19/h1-4,6,8-10,17H,5,7H2
InChIKeyBXKBMXCGRIXBKD-UHFFFAOYSA-N
MW256.28 g/mol
LogP2.80
Rot. Bonds4

About N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine

N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine (PubChem CID 118576981) has the molecular formula C14H13FN4 and a molecular weight of 256.28 g/mol. Its IUPAC name is N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine
PubChem CID118576981
Molecular FormulaC14H13FN4
Molecular Weight256.28 g/mol
Exact Mass256.11
IUPAC NameN-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine
SMILESFCCNc1ccc(-n2ccc3ccncc32)nc1
InChIInChI=1S/C14H13FN4/c15-5-7-17-12-1-2-14(18-9-12)19-8-4-11-3-6-16-10-13(11)19/h1-4,6,8-10,17H,5,7H2
InChIKeyBXKBMXCGRIXBKD-UHFFFAOYSA-N
XLogP2.80
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.28
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-[(E)-2-pyridin-4-ylethenyl]-2-pyridinyl]pyrrolo[2,3-c]pyridine
CID 118585650
5-(2-fluoroethoxy)-3-pyrrolo[2,3-c]pyridin-1-ylisoquinoline
CID 118585714
1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)urea
CID 162568423
tributyl-(6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)stannane
CID 140783416
1-fluoro-7-pyrrolo[2,3-c]pyridin-1-yl-2,6-naphthyridine
CID 118577050
[4-(6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)-2-pyridinyl] thiohypofluorite
CID 144977079
8-methyl-3-pyrrolo[2,3-c]pyridin-1-ylisoquinolin-5-amine
CID 144977078
4-pyrrolo[2,3-c]pyridin-1-ylpyrimidin-2-amine
CID 71580743
(2E,4E)-2-methyl-5-propoxy-N-(6-pyrrolo[2,3-c]pyridin-1-yl-3-pyridinyl)hepta-2,4,6-trienamide
CID 146238665
6-fluoro-3-pyrrolo[2,3-c]pyridin-1-ylisoquinolin-7-amine
CID 118585652
6-(19F)fluoro-3-pyrrolo[2,3-c]pyridin-1-ylisoquinolin-5-amine
CID 169440714
6-fluoro-3-pyrrolo[2,3-c]pyridin-1-ylisoquinolin-5-amine
CID 118577045

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine?
The IUPAC name of N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine (CID 118576981) is N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine.
What is the SMILES notation for N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine?
The canonical SMILES for N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine is FCCNc1ccc(-n2ccc3ccncc32)nc1.
What is the InChIKey of N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine?
The InChIKey is BXKBMXCGRIXBKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN4/c15-5-7-17-12-1-2-14(18-9-12)19-8-4-11-3-6-16-10-13(11)19/h1-4,6,8-10,17H,5,7H2.
What are the key properties of N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine?
N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine has a molecular weight of 256.28 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-6-pyrrolo[2,3-c]pyridin-1-ylpyridin-3-amine is sourced from PubChem (CID 118576981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).