N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide

C10H10F2N2O — CID 105380342

IUPACN-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccnc(F)c1F)C1CC1
InChIInChI=1S/C10H10F2N2O/c1-14(6-2-3-6)10(15)7-4-5-13-9(12)8(7)11/h4-6H,2-3H2,1H3
InChIKeyZTEKDKIGRMHDIA-UHFFFAOYSA-N
MW212.20 g/mol
LogP1.59
Rot. Bonds2

About N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide

N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide (PubChem CID 105380342) has the molecular formula C10H10F2N2O and a molecular weight of 212.20 g/mol. Its IUPAC name is N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide
PubChem CID105380342
Molecular FormulaC10H10F2N2O
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC NameN-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccnc(F)c1F)C1CC1
InChIInChI=1S/C10H10F2N2O/c1-14(6-2-3-6)10(15)7-4-5-13-9(12)8(7)11/h4-6H,2-3H2,1H3
InChIKeyZTEKDKIGRMHDIA-UHFFFAOYSA-N
XLogP1.59
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 51.59
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-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide?
The IUPAC name of N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide (CID 105380342) is N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide is CN(C(=O)c1ccnc(F)c1F)C1CC1.
What is the InChIKey of N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide?
The InChIKey is ZTEKDKIGRMHDIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2O/c1-14(6-2-3-6)10(15)7-4-5-13-9(12)8(7)11/h4-6H,2-3H2,1H3.
What are the key properties of N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide?
N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide has a molecular weight of 212.20 g/mol, XLogP of 1.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,3-difluoro-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 105380342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).