4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide

C14H20N4O2 — CID 107337718

IUPAC4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
SMILESNC(=O)C1CCC(NC(=O)Cc2ccc(N)cn2)CC1
InChIInChI=1S/C14H20N4O2/c15-10-3-6-12(17-8-10)7-13(19)18-11-4-1-9(2-5-11)14(16)20/h3,6,8-9,11H,1-2,4-5,7,15H2,(H2,16,20)(H,18,19)
InChIKeyDDFRZBJVFGERMW-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.37
Rot. Bonds4

About 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide

4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide (PubChem CID 107337718) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
PubChem CID107337718
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
SMILESNC(=O)C1CCC(NC(=O)Cc2ccc(N)cn2)CC1
InChIInChI=1S/C14H20N4O2/c15-10-3-6-12(17-8-10)7-13(19)18-11-4-1-9(2-5-11)14(16)20/h3,6,8-9,11H,1-2,4-5,7,15H2,(H2,16,20)(H,18,19)
InChIKeyDDFRZBJVFGERMW-UHFFFAOYSA-N
XLogP0.37
TPSA111.10 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-amino-2-pyridinyl)-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 107337839
2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
CID 120633539
2-(5-amino-2-pyridinyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide
CID 120618487
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
1-[2-(5-amino-2-pyridinyl)acetyl]piperidine-4-carboxamide
CID 107337428
2-(5-amino-2-pyridinyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide;dihydrochloride
CID 120643499
2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride
CID 120620773
2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride
CID 120633899
2-(5-amino-2-pyridinyl)-N-(2-methylcycloheptyl)acetamide
CID 107339059
2-(5-amino-2-pyridinyl)-N-(2-cyclopropylethyl)acetamide;hydrochloride
CID 120633863

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide?
The IUPAC name of 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide (CID 107337718) is 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide?
The canonical SMILES for 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide is NC(=O)C1CCC(NC(=O)Cc2ccc(N)cn2)CC1.
What is the InChIKey of 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide?
The InChIKey is DDFRZBJVFGERMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c15-10-3-6-12(17-8-10)7-13(19)18-11-4-1-9(2-5-11)14(16)20/h3,6,8-9,11H,1-2,4-5,7,15H2,(H2,16,20)(H,18,19).
What are the key properties of 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide?
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 0.37, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide is sourced from PubChem (CID 107337718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).