N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide

C14H20FN3O — CID 104639321

IUPACN-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(F)cn1)C1CCC(N)CC1
InChIInChI=1S/C14H20FN3O/c1-2-18(12-6-4-11(16)5-7-12)14(19)13-8-3-10(15)9-17-13/h3,8-9,11-12H,2,4-7,16H2,1H3
InChIKeyAQINVAVMSYSZHN-UHFFFAOYSA-N
MW265.33 g/mol
LogP1.95
Rot. Bonds3

About N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide

N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide (PubChem CID 104639321) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide
PubChem CID104639321
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC NameN-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(F)cn1)C1CCC(N)CC1
InChIInChI=1S/C14H20FN3O/c1-2-18(12-6-4-11(16)5-7-12)14(19)13-8-3-10(15)9-17-13/h3,8-9,11-12H,2,4-7,16H2,1H3
InChIKeyAQINVAVMSYSZHN-UHFFFAOYSA-N
XLogP1.95
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminocyclohexyl)-5-chloro-N-ethylpyridine-2-carboxamide
CID 79115416
N-(4-aminocyclohexyl)-5-fluoro-N-methylpyridine-2-carboxamide
CID 104637892
N-(4-aminocyclohexyl)-N-ethyl-5-methylpyrazine-2-carboxamide
CID 79115750
N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-3-carboxamide
CID 104786244
5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide
CID 62953692
N-(4-aminocyclohexyl)-5-bromo-N-propylpyridine-2-carboxamide
CID 79112080
N-(2-chloroethyl)-N-cyclobutyl-5-fluoropyridine-2-carboxamide
CID 102872801
N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide
CID 79115334
N-[(3E)-3-amino-3-hydroxyiminopropyl]-N-cyclopropyl-5-fluoropyridine-2-carboxamide
CID 104639467
N-(4-aminocyclohexyl)-N-ethylbenzamide
CID 79116189
5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide
CID 63723531
N-(4-aminocyclohexyl)-N-ethyl-3-hydroxypyridine-2-carboxamide
CID 79115604

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide?
The IUPAC name of N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide (CID 104639321) is N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide?
The canonical SMILES for N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide is CCN(C(=O)c1ccc(F)cn1)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide?
The InChIKey is AQINVAVMSYSZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c1-2-18(12-6-4-11(16)5-7-12)14(19)13-8-3-10(15)9-17-13/h3,8-9,11-12H,2,4-7,16H2,1H3.
What are the key properties of N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide?
N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide has a molecular weight of 265.33 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide is sourced from PubChem (CID 104639321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).