N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide

C13H16FN3O2 — CID 115645919

IUPACN-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide
SMILESNC(=O)CN(C(=O)c1ccncc1F)C1CCCC1
InChIInChI=1S/C13H16FN3O2/c14-11-7-16-6-5-10(11)13(19)17(8-12(15)18)9-3-1-2-4-9/h5-7,9H,1-4,8H2,(H2,15,18)
InChIKeyYDBOTWCJRGLLSZ-UHFFFAOYSA-N
MW265.29 g/mol
LogP1.09
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide

N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide (PubChem CID 115645919) has the molecular formula C13H16FN3O2 and a molecular weight of 265.29 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide
PubChem CID115645919
Molecular FormulaC13H16FN3O2
Molecular Weight265.29 g/mol
Exact Mass265.12
IUPAC NameN-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide
SMILESNC(=O)CN(C(=O)c1ccncc1F)C1CCCC1
InChIInChI=1S/C13H16FN3O2/c14-11-7-16-6-5-10(11)13(19)17(8-12(15)18)9-3-1-2-4-9/h5-7,9H,1-4,8H2,(H2,15,18)
InChIKeyYDBOTWCJRGLLSZ-UHFFFAOYSA-N
XLogP1.09
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide
CID 115645775
N-(cyclohexylmethyl)-N-cyclopropyl-3-fluoropyridine-4-carboxamide
CID 115646013
N-(3-amino-3-sulfanylidenepropyl)-N-cyclopropyl-3-fluoropyridine-4-carboxamide
CID 64949112
N-cyclohexyl-3-fluoro-N-methylpyridine-4-carboxamide
CID 115645270
N-(2-amino-2-oxoethyl)-3-hydroxy-N-piperidin-3-ylpyridine-4-carboxamide
CID 81445654
5-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-2-fluorobenzamide
CID 61110216
N-[(4-chlorophenyl)methyl]-N-cyclopropyl-3-fluoropyridine-4-carboxamide
CID 115645755
N-(2-amino-2-oxoethyl)-3-hydroxy-N-pyrrolidin-3-ylpyridine-4-carboxamide
CID 81445402
3-fluoro-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide
CID 115645768
N-cyclopropyl-3-fluoro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 115645728
N-cyclohexyl-N-[(3S)-1,1-dioxothiolan-3-yl]-3-fluoropyridine-4-carboxamide
CID 99577019
cyclobutyl-(3-fluoro-4-pyridinyl)methanone
CID 119030457

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide (CID 115645919) is N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide is NC(=O)CN(C(=O)c1ccncc1F)C1CCCC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide?
The InChIKey is YDBOTWCJRGLLSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3O2/c14-11-7-16-6-5-10(11)13(19)17(8-12(15)18)9-3-1-2-4-9/h5-7,9H,1-4,8H2,(H2,15,18).
What are the key properties of N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide?
N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide has a molecular weight of 265.29 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide is sourced from PubChem (CID 115645919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).