N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide

C14H21N3O — CID 82343887

IUPACN-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide
SMILESNCc1cccc(NC(=O)CC2CCCCC2)n1
InChIInChI=1S/C14H21N3O/c15-10-12-7-4-8-13(16-12)17-14(18)9-11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10,15H2,(H,16,17,18)
InChIKeyBLOJULGXSLKAFR-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.45
Rot. Bonds4

About N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide

N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide (PubChem CID 82343887) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide.

Molecular Properties

Compound NameN-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide
PubChem CID82343887
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide
SMILESNCc1cccc(NC(=O)CC2CCCCC2)n1
InChIInChI=1S/C14H21N3O/c15-10-12-7-4-8-13(16-12)17-14(18)9-11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10,15H2,(H,16,17,18)
InChIKeyBLOJULGXSLKAFR-UHFFFAOYSA-N
XLogP2.45
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloropyrimidin-4-yl)-2-cyclohexylacetamide
CID 116798496
N-[3-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide
CID 82344080
6-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide
CID 136527343
N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride
CID 119259903
2-cyclopentyl-N-(4-methylpyrimidin-2-yl)acetamide
CID 167838726
N-(6-fluoro-2-pyridinyl)-2-piperidin-3-ylacetamide
CID 116813334
N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide
CID 103164982
N-(6-chloro-2-pyridinyl)-2-(thian-4-yl)acetamide
CID 115700351
N-(3-amino-2-chlorophenyl)-2-cyclohexylacetamide
CID 114270030
2-cyclohexyl-N-(1-methylpyrazol-3-yl)acetamide
CID 51228914
N-[6-(cyclohexanecarbonylamino)-2-pyridinyl]cyclohexanecarboxamide
CID 5223932
2-cyclopentyl-N-pyridin-4-ylacetamide
CID 11839759

Frequently Asked Questions

What is the IUPAC name of N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide?
The IUPAC name of N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide (CID 82343887) is N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide.
What is the SMILES notation for N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide?
The canonical SMILES for N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide is NCc1cccc(NC(=O)CC2CCCCC2)n1.
What is the InChIKey of N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide?
The InChIKey is BLOJULGXSLKAFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c15-10-12-7-4-8-13(16-12)17-14(18)9-11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10,15H2,(H,16,17,18).
What are the key properties of N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide?
N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide has a molecular weight of 247.34 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide is sourced from PubChem (CID 82343887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).