2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine

C10H13FN2 — CID 55292884

IUPAC2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine
SMILESNC(CC1CC1)c1ccnc(F)c1
InChIInChI=1S/C10H13FN2/c11-10-6-8(3-4-13-10)9(12)5-7-1-2-7/h3-4,6-7,9H,1-2,5,12H2
InChIKeyZNJJVVVZWXCDOJ-UHFFFAOYSA-N
MW180.23 g/mol
LogP2.02
Rot. Bonds3

About 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine

2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine (PubChem CID 55292884) has the molecular formula C10H13FN2 and a molecular weight of 180.23 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine
PubChem CID55292884
Molecular FormulaC10H13FN2
Molecular Weight180.23 g/mol
Exact Mass180.11
IUPAC Name2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine
SMILESNC(CC1CC1)c1ccnc(F)c1
InChIInChI=1S/C10H13FN2/c11-10-6-8(3-4-13-10)9(12)5-7-1-2-7/h3-4,6-7,9H,1-2,5,12H2
InChIKeyZNJJVVVZWXCDOJ-UHFFFAOYSA-N
XLogP2.02
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-amino-2-(2-fluoro-4-pyridinyl)ethanol
CID 55262980
(2R)-2-amino-2-(2-fluoro-4-pyridinyl)ethanol
CID 130829259
(1R)-2-cyclopropyl-1-(4-fluorophenyl)ethanamine
CID 94248777
(2-fluoro-4-pyridinyl)methanediamine
CID 146521385
3-amino-3-(2-fluoro-4-pyridinyl)propanenitrile
CID 55293179
2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride
CID 131637709
2-cyclopropyl-1-(3,5-difluorophenyl)ethanamine
CID 55272126
1-(4-chloro-3-fluorophenyl)-2-cyclopropylethanamine
CID 103693328
1-[4-(aminomethyl)-3-fluorophenyl]-2-cyclopropylethanamine
CID 150062889
(1R)-2-cyclopropyl-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethanamine;hydrochloride
CID 171209483
(1S)-2-cyclopropyl-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanamine;hydrochloride
CID 171222160
(1S)-2-cyclopropyl-1-(3-fluoro-4-methoxyphenyl)ethanamine
CID 94248825

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine?
The IUPAC name of 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine (CID 55292884) is 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine?
The canonical SMILES for 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine is NC(CC1CC1)c1ccnc(F)c1.
What is the InChIKey of 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine?
The InChIKey is ZNJJVVVZWXCDOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2/c11-10-6-8(3-4-13-10)9(12)5-7-1-2-7/h3-4,6-7,9H,1-2,5,12H2.
What are the key properties of 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine?
2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine has a molecular weight of 180.23 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2-fluoro-4-pyridinyl)ethanamine is sourced from PubChem (CID 55292884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).