N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide

C14H21N3O — CID 115273841

IUPACN-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide
SMILESCN(C(=O)CC1CCCCC1)c1ccc(N)cn1
InChIInChI=1S/C14H21N3O/c1-17(13-8-7-12(15)10-16-13)14(18)9-11-5-3-2-4-6-11/h7-8,10-11H,2-6,9,15H2,1H3
InChIKeyWSTQCUOCJGQFLY-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.60
Rot. Bonds3

About N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide

N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide (PubChem CID 115273841) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide.

Molecular Properties

Compound NameN-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide
PubChem CID115273841
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide
SMILESCN(C(=O)CC1CCCCC1)c1ccc(N)cn1
InChIInChI=1S/C14H21N3O/c1-17(13-8-7-12(15)10-16-13)14(18)9-11-5-3-2-4-6-11/h7-8,10-11H,2-6,9,15H2,1H3
InChIKeyWSTQCUOCJGQFLY-UHFFFAOYSA-N
XLogP2.60
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-2-pyridinyl)-2-cyclopentyl-N-propan-2-ylacetamide
CID 115273938
2-(5-amino-2-pyridinyl)-N-cyclohexyl-N-methylacetamide
CID 107337433
N-(5-amino-2-pyridinyl)-3-cyclobutyl-N-cyclopropylpropanamide
CID 115273970
2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide
CID 43210198
N-(5-amino-2-pyridinyl)-2,2,2-trifluoro-N-methylacetamide
CID 130646725
2-cyclopentyl-N-(4-hydroxyphenyl)-N-methylacetamide
CID 28738996
N-[(5-amino-2-chlorophenyl)methyl]-2-cycloheptyl-N-methylacetamide
CID 114457040
6-[2-[cyclohexylmethyl(methyl)amino]ethyl]pyridin-3-amine
CID 107340126
N-(4-carbamothioylphenyl)-2-cyclohexyl-N-methylacetamide
CID 62970842
N-(5-cyano-2-pyridinyl)-3-cyclopentyl-N-methylpropanamide
CID 115273575
N-[[4-(aminomethyl)phenyl]methyl]-2-cycloheptyl-N-methylacetamide
CID 114456974
2-(cyclohexylmethylamino)-N-methyl-N-pyridin-2-ylacetamide
CID 101057675

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide?
The IUPAC name of N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide (CID 115273841) is N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide.
What is the SMILES notation for N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide?
The canonical SMILES for N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide is CN(C(=O)CC1CCCCC1)c1ccc(N)cn1.
What is the InChIKey of N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide?
The InChIKey is WSTQCUOCJGQFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-17(13-8-7-12(15)10-16-13)14(18)9-11-5-3-2-4-6-11/h7-8,10-11H,2-6,9,15H2,1H3.
What are the key properties of N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide?
N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide has a molecular weight of 247.34 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-pyridinyl)-2-cyclohexyl-N-methylacetamide is sourced from PubChem (CID 115273841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).