[4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine

C9H13FN2 — CID 84765426

IUPAC[4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine
SMILESCC(C)(F)c1ccnc(CN)c1
InChIInChI=1S/C9H13FN2/c1-9(2,10)7-3-4-12-8(5-7)6-11/h3-5H,6,11H2,1-2H3
InChIKeyHAFCFTULVYDQDR-UHFFFAOYSA-N
MW168.21 g/mol
LogP1.74
Rot. Bonds2

About [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine

[4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine (PubChem CID 84765426) has the molecular formula C9H13FN2 and a molecular weight of 168.21 g/mol. Its IUPAC name is [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine
PubChem CID84765426
Molecular FormulaC9H13FN2
Molecular Weight168.21 g/mol
Exact Mass168.11
IUPAC Name[4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine
SMILESCC(C)(F)c1ccnc(CN)c1
InChIInChI=1S/C9H13FN2/c1-9(2,10)7-3-4-12-8(5-7)6-11/h3-5H,6,11H2,1-2H3
InChIKeyHAFCFTULVYDQDR-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

1-(4-tert-butyl-2-pyridinyl)-2-methylpropan-2-amine
CID 130305406
(4-tert-butyl-2-pyridinyl)methanol
CID 18799645
[4-[5-(trifluoromethyl)pyrimidin-2-yl]-2-pyridinyl]methanamine
CID 122693562
ethane;(4-methyl-2-pyridinyl)methanamine
CID 142030002
2-(chloromethyl)-4-(trifluoromethyl)pyridine;hydrochloride
CID 121232314
[4-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanamine
CID 70982353
(4-chloro-2-pyridinyl)methanamine
CID 22727148
[2-(aminomethyl)-4-pyridinyl]-[4-(trifluoromethyl)phenyl]methanone
CID 116601926
1-(4-tert-butyl-2-pyridinyl)propan-2-one
CID 91432972
4-tert-butyl-2-pentylpyridine
CID 129189676
CID 67485897
CID 67485897
1-[2-(aminomethyl)-4-pyridinyl]ethanamine
CID 142264810

Frequently Asked Questions

What is the IUPAC name of [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine?
The IUPAC name of [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine (CID 84765426) is [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine?
The canonical SMILES for [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine is CC(C)(F)c1ccnc(CN)c1.
What is the InChIKey of [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine?
The InChIKey is HAFCFTULVYDQDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN2/c1-9(2,10)7-3-4-12-8(5-7)6-11/h3-5H,6,11H2,1-2H3.
What are the key properties of [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine?
[4-(2-fluoropropan-2-yl)-2-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 [4-(2-fluoropropan-2-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 84765426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).