N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine

C13H17FN2 — CID 79508323

IUPACN-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine
SMILESFc1ccccc1CCNC1=NCCCC1
InChIInChI=1S/C13H17FN2/c14-12-6-2-1-5-11(12)8-10-16-13-7-3-4-9-15-13/h1-2,5-6H,3-4,7-10H2,(H,15,16)
InChIKeyWXOVKFYVKCDLNA-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.54
Rot. Bonds3

About N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine

N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine (PubChem CID 79508323) has the molecular formula C13H17FN2 and a molecular weight of 220.29 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine
PubChem CID79508323
Molecular FormulaC13H17FN2
Molecular Weight220.29 g/mol
Exact Mass220.14
IUPAC NameN-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine
SMILESFc1ccccc1CCNC1=NCCCC1
InChIInChI=1S/C13H17FN2/c14-12-6-2-1-5-11(12)8-10-16-13-7-3-4-9-15-13/h1-2,5-6H,3-4,7-10H2,(H,15,16)
InChIKeyWXOVKFYVKCDLNA-UHFFFAOYSA-N
XLogP2.54
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-fluorophenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 79508216
N-[2-(4-chlorophenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 21395144
N-[2-(2,4-dichlorophenyl)ethyl]-3,4-dihydro-2H-pyrrol-5-amine
CID 78909268
N-(2-pyridin-2-ylethyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 79508326
N-[2-(3,5-difluorophenyl)ethyl]-3,4-dihydro-2H-pyrrol-5-amine
CID 79508804
N-(2-pyridin-4-ylethyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 79508874
N-(2-chloroethyl)-2,3,4,5-tetrahydropyridin-6-amine;hydrochloride
CID 71308035
1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 60867022
N-[(2-methylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
CID 20595374
N'-[2-(2-fluorophenyl)ethyl]-N-methylmethanediamine
CID 115227243
N-(2-methyl-2-phenylpropyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 79507704
6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine
CID 63963216

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine?
The IUPAC name of N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine (CID 79508323) is N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine.
What is the SMILES notation for N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine?
The canonical SMILES for N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine is Fc1ccccc1CCNC1=NCCCC1.
What is the InChIKey of N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine?
The InChIKey is WXOVKFYVKCDLNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2/c14-12-6-2-1-5-11(12)8-10-16-13-7-3-4-9-15-13/h1-2,5-6H,3-4,7-10H2,(H,15,16).
What are the key properties of N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine?
N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine has a molecular weight of 220.29 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine is sourced from PubChem (CID 79508323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).