6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile

C14H12FN3 — CID 24694772

IUPAC6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile
SMILESN#Cc1ccc(NCCc2ccccc2F)nc1
InChIInChI=1S/C14H12FN3/c15-13-4-2-1-3-12(13)7-8-17-14-6-5-11(9-16)10-18-14/h1-6,10H,7-8H2,(H,17,18)
InChIKeyDKSSBHREAKKXNS-UHFFFAOYSA-N
MW241.27 g/mol
LogP2.75
Rot. Bonds4

About 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile

6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile (PubChem CID 24694772) has the molecular formula C14H12FN3 and a molecular weight of 241.27 g/mol. Its IUPAC name is 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile
PubChem CID24694772
Molecular FormulaC14H12FN3
Molecular Weight241.27 g/mol
Exact Mass241.10
IUPAC Name6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile
SMILESN#Cc1ccc(NCCc2ccccc2F)nc1
InChIInChI=1S/C14H12FN3/c15-13-4-2-1-3-12(13)7-8-17-14-6-5-11(9-16)10-18-14/h1-6,10H,7-8H2,(H,17,18)
InChIKeyDKSSBHREAKKXNS-UHFFFAOYSA-N
XLogP2.75
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[2-(2,4-difluorophenyl)ethylamino]pyridine-3-carbonitrile
CID 133302426
6-[2-(2-cyano-3-fluoroanilino)ethylamino]pyridine-3-carbonitrile
CID 47030143
6-(2-aminoethylamino)pyridine-3-carbonitrile
CID 11369405
6-(3,3-diphenylpropylamino)pyridine-3-carbonitrile
CID 52545859
6-[2-(4-aminophenyl)ethylamino]pyridine-3-carbonitrile
CID 61220422
6-(3-phenoxypropylamino)pyridine-3-carbonitrile
CID 60706290
4-[2-(2-fluorophenyl)ethylamino]-3-methylbenzonitrile
CID 54934414
6-[3-(3-fluorophenyl)propylamino]pyridine-3-carbonitrile
CID 133294986
2-[2-[[(5-cyano-2-pyridinyl)amino]methyl]phenyl]acetic acid
CID 81318485
N-(2-fluorophenyl)-6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109158516
N-[2-(2-fluorophenyl)ethyl]-5,6-dimethylpyrazin-2-amine
CID 114475197
(1S,3R,4R)-4-[(5-cyano-2-pyridinyl)amino]-N-[2-(2-fluorophenyl)ethyl]-3-methoxycyclohexane-1-carboxamide
CID 157013381

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile?
The IUPAC name of 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile (CID 24694772) is 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile?
The canonical SMILES for 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile is N#Cc1ccc(NCCc2ccccc2F)nc1.
What is the InChIKey of 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile?
The InChIKey is DKSSBHREAKKXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3/c15-13-4-2-1-3-12(13)7-8-17-14-6-5-11(9-16)10-18-14/h1-6,10H,7-8H2,(H,17,18).
What are the key properties of 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile?
6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile has a molecular weight of 241.27 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-fluorophenyl)ethylamino]pyridine-3-carbonitrile is sourced from PubChem (CID 24694772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).