[6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine

C9H13FN2 — CID 142385904

IUPAC[6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine
SMILESCC(C)(F)c1ccc(CN)cn1
InChIInChI=1S/C9H13FN2/c1-9(2,10)8-4-3-7(5-11)6-12-8/h3-4,6H,5,11H2,1-2H3
InChIKeyOPACCRKGRDPEEB-UHFFFAOYSA-N
MW168.21 g/mol
LogP1.74
Rot. Bonds2

About [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine

[6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine (PubChem CID 142385904) has the molecular formula C9H13FN2 and a molecular weight of 168.21 g/mol. Its IUPAC name is [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine
PubChem CID142385904
Molecular FormulaC9H13FN2
Molecular Weight168.21 g/mol
Exact Mass168.11
IUPAC Name[6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine
SMILESCC(C)(F)c1ccc(CN)cn1
InChIInChI=1S/C9H13FN2/c1-9(2,10)8-4-3-7(5-11)6-12-8/h3-4,6H,5,11H2,1-2H3
InChIKeyOPACCRKGRDPEEB-UHFFFAOYSA-N
XLogP1.74
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.21
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[6-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-pyridinyl]methanamine
CID 176908126
2,3-difluoropyridine;methane;[6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 159348275
[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]-3-pyridinyl]methanamine
CID 155289861
5-(bromomethyl)-2-(1,1-difluoroethyl)pyridine
CID 59218632
N-[5-(aminomethyl)-2-pyridinyl]-2-methylpropane-2-sulfonamide
CID 63687650
(6-methyl-3-pyridinyl)methanamine;hydrobromide
CID 133057273
[6-(3,3,3-trifluoropropyl)-3-pyridinyl]methanamine;hydrochloride
CID 67508680
(6-bromo-3-pyridinyl)methanamine
CID 22450529
5-(fluoromethyl)-2-(trifluoromethyl)pyridine
CID 177038549
5-propyl-2-(trifluoromethyl)pyridine
CID 23544356
1-[[5-(aminomethyl)-2-pyridinyl]oxy]-2-methylpropan-2-ol
CID 67042824
[4-(2,2-difluoropropyl)phenyl]methanamine
CID 84660094

Frequently Asked Questions

What is the IUPAC name of [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine?
The IUPAC name of [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine (CID 142385904) is [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine?
The canonical SMILES for [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine is CC(C)(F)c1ccc(CN)cn1.
What is the InChIKey of [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine?
The InChIKey is OPACCRKGRDPEEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN2/c1-9(2,10)8-4-3-7(5-11)6-12-8/h3-4,6H,5,11H2,1-2H3.
What are the key properties of [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine?
[6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine has a molecular weight of 168.21 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-fluoropropan-2-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 142385904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).