3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide

C11H13FN2O — CID 172858833

IUPAC3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide
SMILESCN(C(=O)c1ncccc1F)C1(C)CC1
InChIInChI=1S/C11H13FN2O/c1-11(5-6-11)14(2)10(15)9-8(12)4-3-7-13-9/h3-4,7H,5-6H2,1-2H3
InChIKeyZBSGXTHAXQVKCR-UHFFFAOYSA-N
MW208.24 g/mol
LogP1.85
Rot. Bonds2

About 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide

3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide (PubChem CID 172858833) has the molecular formula C11H13FN2O and a molecular weight of 208.24 g/mol. Its IUPAC name is 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide
PubChem CID172858833
Molecular FormulaC11H13FN2O
Molecular Weight208.24 g/mol
Exact Mass208.10
IUPAC Name3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide
SMILESCN(C(=O)c1ncccc1F)C1(C)CC1
InChIInChI=1S/C11H13FN2O/c1-11(5-6-11)14(2)10(15)9-8(12)4-3-7-13-9/h3-4,7H,5-6H2,1-2H3
InChIKeyZBSGXTHAXQVKCR-UHFFFAOYSA-N
XLogP1.85
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 110474737
N-[3-(dimethylamino)propyl]-3-fluoropyridine-2-carboxamide
CID 110474763
(E)-3-(dimethylamino)-2-(3-fluoropyridine-2-carbonyl)prop-2-enoic acid
CID 90272115
3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 104741078
CID 140752568
CID 140752568
ethyl 3-fluoropyridine-2-carboxylate
CID 46311381
(2E)-2-ethylidene-1-(3-fluoro-2-pyridinyl)butane-1,3-dione
CID 90276186
2-ethylidene-1-(3-fluoro-2-pyridinyl)butane-1,3-dione
CID 148826294
2-[1-[methyl-(3-methylpyridine-2-carbonyl)amino]cyclohexyl]acetic acid
CID 65237888
3-fluoro-N-[4-(hydroxymethyl)-1-methylpiperidin-4-yl]pyridine-2-carboxamide
CID 134434700
N-cyclopentyl-3-fluoropyridine-2-carboxamide
CID 83407062
1-(3-fluoro-2-pyridinyl)cyclopropane-1-carboxylic acid
CID 84657708

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide?
The IUPAC name of 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide (CID 172858833) is 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide?
The canonical SMILES for 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide is CN(C(=O)c1ncccc1F)C1(C)CC1.
What is the InChIKey of 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide?
The InChIKey is ZBSGXTHAXQVKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O/c1-11(5-6-11)14(2)10(15)9-8(12)4-3-7-13-9/h3-4,7H,5-6H2,1-2H3.
What are the key properties of 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide?
3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide has a molecular weight of 208.24 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-methyl-N-(1-methylcyclopropyl)pyridine-2-carboxamide is sourced from PubChem (CID 172858833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).