3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine

C8H10F2N2 — CID 159515003

IUPAC3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine
SMILESC=C1C(C(F)F)=CC(C)=CN1N
InChIInChI=1S/C8H10F2N2/c1-5-3-7(8(9)10)6(2)12(11)4-5/h3-4,8H,2,11H2,1H3
InChIKeyLMXGMEHTJWMFAK-UHFFFAOYSA-N
MW172.18 g/mol
LogP1.78
Rot. Bonds1

About 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine

3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine (PubChem CID 159515003) has the molecular formula C8H10F2N2 and a molecular weight of 172.18 g/mol. Its IUPAC name is 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine.

Molecular Properties

Compound Name3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine
PubChem CID159515003
Molecular FormulaC8H10F2N2
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC Name3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine
SMILESC=C1C(C(F)F)=CC(C)=CN1N
InChIInChI=1S/C8H10F2N2/c1-5-3-7(8(9)10)6(2)12(11)4-5/h3-4,8H,2,11H2,1H3
InChIKeyLMXGMEHTJWMFAK-UHFFFAOYSA-N
XLogP1.78
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

1-Methyl-1-[4-(trifluoromethyl)penta-2,4-dien-2-yl]hydrazine
CID 123378318
1-N,1-N-dimethyl-5-(trifluoromethyl)-2H-pyridine-1,3-diamine
CID 154495491
1-[(3Z,5E)-2-methyl-5-(trifluoromethyl)hepta-3,5-dien-3-yl]-1-propan-2-ylhydrazine
CID 156476918
3-methyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium
CID 160530658
N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium
CID 160667563
N,N-dimethyl-2-methylidene-5-(trifluoromethyl)pyridin-1-amine
CID 163687782
(2E)-2-[(E)-3-fluorobut-2-enylidene]-4-methyl-3-methylidenepyrrol-1-amine
CID 142944784
3-fluoro-N,5-dimethyl-2-methylidenepyridin-1-amine
CID 147857381
3-(Difluoromethyl)-1,5-dimethyl-2-methylidenepyridine
CID 148346678
6,7-Dimethyl-5-(trifluoromethyl)-2,3-dihydroazepin-1-amine
CID 153013336
3-fluoro-N,N,5-trimethyl-2-methylidenepyridin-1-amine
CID 158083783
1,5-Dimethyl-2-methylidene-3-(trifluoromethyl)pyridine
CID 158142945

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine?
The IUPAC name of 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine (CID 159515003) is 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine.
What is the SMILES notation for 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine?
The canonical SMILES for 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine is C=C1C(C(F)F)=CC(C)=CN1N.
What is the InChIKey of 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine?
The InChIKey is LMXGMEHTJWMFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2/c1-5-3-7(8(9)10)6(2)12(11)4-5/h3-4,8H,2,11H2,1H3.
What are the key properties of 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine?
3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine has a molecular weight of 172.18 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine is sourced from PubChem (CID 159515003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).