[2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine

C8H10F2N2 — CID 130097549

IUPAC[2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine
SMILESCc1ccnc(C(F)F)c1CN
InChIInChI=1S/C8H10F2N2/c1-5-2-3-12-7(8(9)10)6(5)4-11/h2-3,8H,4,11H2,1H3
InChIKeyNUSCWGGCBDXILC-UHFFFAOYSA-N
MW172.18 g/mol
LogP1.79
Rot. Bonds2

About [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine

[2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine (PubChem CID 130097549) has the molecular formula C8H10F2N2 and a molecular weight of 172.18 g/mol. Its IUPAC name is [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine
PubChem CID130097549
Molecular FormulaC8H10F2N2
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC Name[2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine
SMILESCc1ccnc(C(F)F)c1CN
InChIInChI=1S/C8H10F2N2/c1-5-2-3-12-7(8(9)10)6(5)4-11/h2-3,8H,4,11H2,1H3
InChIKeyNUSCWGGCBDXILC-UHFFFAOYSA-N
XLogP1.79
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-[2-(difluoromethyl)-4-methyl-3-pyridinyl]acetate
CID 134673374
3-(aminomethyl)-2-(difluoromethyl)pyridine-4-carboxylic acid
CID 130098061
2-(difluoromethyl)-3-(fluoromethyl)-4-iodopyridine
CID 130096732
5-(aminomethyl)-6-(difluoromethyl)-4-methylpyridin-3-amine
CID 130106307
(2-methoxy-4-methyl-3-pyridinyl)methanamine
CID 78992169
4-(aminomethyl)-2-(difluoromethyl)pyridin-3-ol
CID 130097022
2-(difluoromethyl)-4-methyl-3-(trifluoromethyl)pyridine
CID 130097652
[3-chloro-2-(difluoromethyl)-5-methyl-4-pyridinyl]methanamine
CID 118829811
2-[4-(chloromethyl)-2-(difluoromethyl)-3-pyridinyl]acetic acid
CID 134683944
[2-(difluoromethyl)-3-(trifluoromethyl)-4-pyridinyl]methanamine
CID 118818433
[2-(difluoromethyl)-5-fluoro-3-methyl-4-pyridinyl]methanamine
CID 130080922
4-(aminomethyl)-2-(difluoromethyl)-5-methylpyridine-3-carbaldehyde
CID 130088514

Frequently Asked Questions

What is the IUPAC name of [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine?
The IUPAC name of [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine (CID 130097549) is [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine.
What is the SMILES notation for [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine?
The canonical SMILES for [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine is Cc1ccnc(C(F)F)c1CN.
What is the InChIKey of [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine?
The InChIKey is NUSCWGGCBDXILC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2/c1-5-2-3-12-7(8(9)10)6(5)4-11/h2-3,8H,4,11H2,1H3.
What are the key properties of [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine?
[2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine has a molecular weight of 172.18 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(difluoromethyl)-4-methyl-3-pyridinyl]methanamine is sourced from PubChem (CID 130097549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).