2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride

C15H24ClN3O — CID 120633539

IUPAC2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
SMILESCC1(C)CCC(NC(=O)Cc2ccc(N)cn2)CC1.Cl
InChIInChI=1S/C15H23N3O.ClH/c1-15(2)7-5-12(6-8-15)18-14(19)9-13-4-3-11(16)10-17-13;/h3-4,10,12H,5-9,16H2,1-2H3,(H,18,19);1H
InChIKeyQSEDHGGDLKKIQG-UHFFFAOYSA-N
MW297.83 g/mol
LogP2.71
Rot. Bonds3

About 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride (PubChem CID 120633539) has the molecular formula C15H24ClN3O and a molecular weight of 297.83 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
PubChem CID120633539
Molecular FormulaC15H24ClN3O
Molecular Weight297.83 g/mol
Exact Mass297.16
IUPAC Name2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
SMILESCC1(C)CCC(NC(=O)Cc2ccc(N)cn2)CC1.Cl
InChIInChI=1S/C15H23N3O.ClH/c1-15(2)7-5-12(6-8-15)18-14(19)9-13-4-3-11(16)10-17-13;/h3-4,10,12H,5-9,16H2,1-2H3,(H,18,19);1H
InChIKeyQSEDHGGDLKKIQG-UHFFFAOYSA-N
XLogP2.71
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.83
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
CID 107337718
2-(5-amino-2-pyridinyl)-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 107337839
2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide
CID 120618487
2-(5-amino-2-pyridinyl)-N-[(1-methylcyclopropyl)methyl]acetamide;hydrochloride
CID 120635774
2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride
CID 120620773
2-(5-amino-2-pyridinyl)-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]acetamide
CID 107339008
2-(5-amino-2-pyridinyl)-N-cyclohex-3-en-1-ylacetamide
CID 107339064
2-(5-amino-2-pyridinyl)-N-(oxolan-3-yl)acetamide
CID 107339286
2-(5-amino-2-pyridinyl)-N-(thiolan-3-yl)acetamide
CID 107339832
2-(5-amino-2-pyridinyl)-N-(2-tert-butylcyclohexyl)acetamide;hydrochloride
CID 120621478
2-(5-amino-2-pyridinyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide;dihydrochloride
CID 120643499
2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride
CID 120633899

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride (CID 120633539) is 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride is CC1(C)CCC(NC(=O)Cc2ccc(N)cn2)CC1.Cl.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride?
The InChIKey is QSEDHGGDLKKIQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O.ClH/c1-15(2)7-5-12(6-8-15)18-14(19)9-13-4-3-11(16)10-17-13;/h3-4,10,12H,5-9,16H2,1-2H3,(H,18,19);1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride has a molecular weight of 297.83 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride is sourced from PubChem (CID 120633539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).