N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine

C10H10F4N2 — CID 79905242

IUPACN-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine
SMILESCN(CC1CC1)c1c(F)c(F)nc(F)c1F
InChIInChI=1S/C10H10F4N2/c1-16(4-5-2-3-5)8-6(11)9(13)15-10(14)7(8)12/h5H,2-4H2,1H3
InChIKeyKOXNDXFYRDCANK-UHFFFAOYSA-N
MW234.20 g/mol
LogP2.48
Rot. Bonds3

About N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine

N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine (PubChem CID 79905242) has the molecular formula C10H10F4N2 and a molecular weight of 234.20 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine
PubChem CID79905242
Molecular FormulaC10H10F4N2
Molecular Weight234.20 g/mol
Exact Mass234.08
IUPAC NameN-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine
SMILESCN(CC1CC1)c1c(F)c(F)nc(F)c1F
InChIInChI=1S/C10H10F4N2/c1-16(4-5-2-3-5)8-6(11)9(13)15-10(14)7(8)12/h5H,2-4H2,1H3
InChIKeyKOXNDXFYRDCANK-UHFFFAOYSA-N
XLogP2.48
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.20
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine (CID 79905242) is N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine is CN(CC1CC1)c1c(F)c(F)nc(F)c1F.
What is the InChIKey of N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine?
The InChIKey is KOXNDXFYRDCANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F4N2/c1-16(4-5-2-3-5)8-6(11)9(13)15-10(14)7(8)12/h5H,2-4H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine?
N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine has a molecular weight of 234.20 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2,3,5,6-tetrafluoro-N-methylpyridin-4-amine is sourced from PubChem (CID 79905242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).