N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide

C15H23N3O2 — CID 113010320

IUPACN-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide
SMILESCOCCNc1ccc(NC(=O)C2CCCCC2)cn1
InChIInChI=1S/C15H23N3O2/c1-20-10-9-16-14-8-7-13(11-17-14)18-15(19)12-5-3-2-4-6-12/h7-8,11-12H,2-6,9-10H2,1H3,(H,16,17)(H,18,19)
InChIKeyZNXRGJOELXILQL-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.66
Rot. Bonds6

About N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide

N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide (PubChem CID 113010320) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide
PubChem CID113010320
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide
SMILESCOCCNc1ccc(NC(=O)C2CCCCC2)cn1
InChIInChI=1S/C15H23N3O2/c1-20-10-9-16-14-8-7-13(11-17-14)18-15(19)12-5-3-2-4-6-12/h7-8,11-12H,2-6,9-10H2,1H3,(H,16,17)(H,18,19)
InChIKeyZNXRGJOELXILQL-UHFFFAOYSA-N
XLogP2.66
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclopropanecarboxamide
CID 113010317
N-[6-(3-methylbutylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113015064
N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide
CID 113009028
N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]cyclobutanecarboxamide
CID 113010772
N-[6-(tert-butylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113014760
N-[6-(cyclopentylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 113009854
N-[5-(butylamino)-2-pyridinyl]cyclohexanecarboxamide
CID 113023958
N-[6-(butanoylamino)-3-pyridinyl]cyclohexanecarboxamide
CID 1452761
N-[4-(2-methoxyethylamino)phenyl]cyclopropanecarboxamide
CID 112980891
N-[6-[(2-cycloheptyloxyacetyl)amino]-3-pyridinyl]cyclobutanecarboxamide
CID 166280251
N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]cyclohexanecarboxamide
CID 113012101
N-[6-(4-chloroanilino)-3-pyridinyl]cyclohexanecarboxamide
CID 113018586

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide?
The IUPAC name of N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide (CID 113010320) is N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide?
The canonical SMILES for N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide is COCCNc1ccc(NC(=O)C2CCCCC2)cn1.
What is the InChIKey of N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide?
The InChIKey is ZNXRGJOELXILQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-20-10-9-16-14-8-7-13(11-17-14)18-15(19)12-5-3-2-4-6-12/h7-8,11-12H,2-6,9-10H2,1H3,(H,16,17)(H,18,19).
What are the key properties of N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide?
N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methoxyethylamino)-3-pyridinyl]cyclohexanecarboxamide is sourced from PubChem (CID 113010320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).