N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide

C13H17FN2O — CID 115645775

IUPACN-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide
SMILESCCN(C(=O)c1ccncc1F)C1CCCC1
InChIInChI=1S/C13H17FN2O/c1-2-16(10-5-3-4-6-10)13(17)11-7-8-15-9-12(11)14/h7-10H,2-6H2,1H3
InChIKeySMKKBHDCRRJZGT-UHFFFAOYSA-N
MW236.29 g/mol
LogP2.63
Rot. Bonds3

About N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide

N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide (PubChem CID 115645775) has the molecular formula C13H17FN2O and a molecular weight of 236.29 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide
PubChem CID115645775
Molecular FormulaC13H17FN2O
Molecular Weight236.29 g/mol
Exact Mass236.13
IUPAC NameN-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide
SMILESCCN(C(=O)c1ccncc1F)C1CCCC1
InChIInChI=1S/C13H17FN2O/c1-2-16(10-5-3-4-6-10)13(17)11-7-8-15-9-12(11)14/h7-10H,2-6H2,1H3
InChIKeySMKKBHDCRRJZGT-UHFFFAOYSA-N
XLogP2.63
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-oxoethyl)-N-cyclopentyl-3-fluoropyridine-4-carboxamide
CID 115645919
3-chloro-N-cyclohexyl-N-ethylpyridine-4-carboxamide
CID 66464797
N-cyclohexyl-3-fluoro-N-methylpyridine-4-carboxamide
CID 115645270
N-(cyclohexylmethyl)-N-cyclopropyl-3-fluoropyridine-4-carboxamide
CID 115646013
4-amino-N-cyclopentyl-N-ethylpyridine-3-carboxamide
CID 81242271
N-cyclopentyl-N-ethyl-4-(methylamino)pyridine-3-carboxamide
CID 81242486
N-cyclopentyl-N-ethyl-4-hydrazinylpyridine-3-carboxamide
CID 81256694
3-amino-N-cyclopropyl-N-ethylpyridine-4-carboxamide
CID 105068531
N-[(4-chlorophenyl)methyl]-N-cyclopropyl-3-fluoropyridine-4-carboxamide
CID 115645755
3-fluoro-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide
CID 115645768
N-cyclohexyl-N-[(3S)-1,1-dioxothiolan-3-yl]-3-fluoropyridine-4-carboxamide
CID 99577019
N-cyclopentyl-N-ethyl-2,3-difluorobenzamide
CID 55101771

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide?
The IUPAC name of N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide (CID 115645775) is N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide is CCN(C(=O)c1ccncc1F)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide?
The InChIKey is SMKKBHDCRRJZGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O/c1-2-16(10-5-3-4-6-10)13(17)11-7-8-15-9-12(11)14/h7-10H,2-6H2,1H3.
What are the key properties of N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide?
N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide has a molecular weight of 236.29 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-3-fluoropyridine-4-carboxamide is sourced from PubChem (CID 115645775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).