(3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride

C7H10ClFN2 — CID 53395629

IUPAC(3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride
SMILESCc1ccc(F)c(CN)n1.Cl
InChIInChI=1S/C7H9FN2.ClH/c1-5-2-3-6(8)7(4-9)10-5;/h2-3H,4,9H2,1H3;1H
InChIKeyMWBCVZKPEVMFBS-UHFFFAOYSA-N
MW176.62 g/mol
LogP1.41
Rot. Bonds1

About (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride

(3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride (PubChem CID 53395629) has the molecular formula C7H10ClFN2 and a molecular weight of 176.62 g/mol. Its IUPAC name is (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride
PubChem CID53395629
Molecular FormulaC7H10ClFN2
Molecular Weight176.62 g/mol
Exact Mass176.05
IUPAC Name(3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride
SMILESCc1ccc(F)c(CN)n1.Cl
InChIInChI=1S/C7H9FN2.ClH/c1-5-2-3-6(8)7(4-9)10-5;/h2-3H,4,9H2,1H3;1H
InChIKeyMWBCVZKPEVMFBS-UHFFFAOYSA-N
XLogP1.41
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.62
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride?
The IUPAC name of (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride (CID 53395629) is (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride.
What is the SMILES notation for (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride?
The canonical SMILES for (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride is Cc1ccc(F)c(CN)n1.Cl.
What is the InChIKey of (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride?
The InChIKey is MWBCVZKPEVMFBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2.ClH/c1-5-2-3-6(8)7(4-9)10-5;/h2-3H,4,9H2,1H3;1H.
What are the key properties of (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride?
(3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride has a molecular weight of 176.62 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-6-methyl-2-pyridinyl)methanamine;hydrochloride is sourced from PubChem (CID 53395629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).