2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine

C10H14F2N2O — CID 103183274

IUPAC2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine
SMILESCc1cnc(COCC(F)F)c(C)c1N
InChIInChI=1S/C10H14F2N2O/c1-6-3-14-8(7(2)10(6)13)4-15-5-9(11)12/h3,9H,4-5H2,1-2H3,(H2,13,14)
InChIKeyGZHYOIIZMGTGPO-UHFFFAOYSA-N
MW216.23 g/mol
LogP2.06
Rot. Bonds4

About 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine

2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine (PubChem CID 103183274) has the molecular formula C10H14F2N2O and a molecular weight of 216.23 g/mol. Its IUPAC name is 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine.

Molecular Properties

Compound Name2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine
PubChem CID103183274
Molecular FormulaC10H14F2N2O
Molecular Weight216.23 g/mol
Exact Mass216.11
IUPAC Name2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine
SMILESCc1cnc(COCC(F)F)c(C)c1N
InChIInChI=1S/C10H14F2N2O/c1-6-3-14-8(7(2)10(6)13)4-15-5-9(11)12/h3,9H,4-5H2,1-2H3,(H2,13,14)
InChIKeyGZHYOIIZMGTGPO-UHFFFAOYSA-N
XLogP2.06
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.23
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-3-amino-4-methoxymethyl-5-aminomethylpyridine
CID 142021
5-Aminomethyl-4-methoxymethyl-2-methyl-pyridin-3-ylamine
CID 6602536
(S)-4-(tert-Butyl)-2-(5-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole
CID 71712916
4-(tert-Butyl)-2-(5-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole
CID 78155655
2-(4,5-Dihydro-2-oxazolyl)-5-(trifluoromethyl)pyridine
CID 142590989
Methyl 5-ethynylpyridine-2-carboximidate
CID 137963920
(R)-4-(tert-Butyl)-2-(5-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole
CID 91659015
(S)-4-(tert-Butyl)-2-(4-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole
CID 97182182
2-(1-Butoxyethenyl)-5-(trifluoromethyl)pyridine
CID 121013056
(R)-4-Phenyl-2-(5-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole
CID 132938604
(R)-4-Isopropyl-2-(5-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole
CID 134159315
2-[(4S)-4-Isobutyl-4,5-dihydro-2-oxazolyl]-5-(trifluoromethyl)pyridine
CID 134861247

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine?
The IUPAC name of 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine (CID 103183274) is 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine.
What is the SMILES notation for 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine?
The canonical SMILES for 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine is Cc1cnc(COCC(F)F)c(C)c1N.
What is the InChIKey of 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine?
The InChIKey is GZHYOIIZMGTGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2O/c1-6-3-14-8(7(2)10(6)13)4-15-5-9(11)12/h3,9H,4-5H2,1-2H3,(H2,13,14).
What are the key properties of 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine?
2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine has a molecular weight of 216.23 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluoroethoxymethyl)-3,5-dimethylpyridin-4-amine is sourced from PubChem (CID 103183274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).