5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine

C144H218N20O10S2 — CID 158390738

IUPAC5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine
SMILESCC(=O)Nc1ccc(C(C)(C)C)cn1.CC(=O)c1ccc(C(C)(C)C)cn1.CC(C)(C)c1ccc(C(=O)NC2CC2)nc1.CC(C)(C)c1ccc(N2CCCC2)nc1.CC(C)(C)c1ccc(OCCCN2CCCCC2)nc1.CC(C)(C)c1ccc(OCCN2CCOCC2)nc1.CC(C)(C)c1cncc(S(C)(=O)=O)c1.CCNC(=O)c1ccc(C(C)(C)C)cn1.CN(C)c1ccc(C(C)(C)C)cn1.CNC(=O)c1ccc(C(C)(C)C)cn1.CSc1ccc(C(C)(C)C)cn1.Cc1ccc(C(C)(C)C)cn1
InChIInChI=1S/C17H28N2O.C15H24N2O2.C13H18N2O.C13H20N2.C12H18N2O.2C11H16N2O.C11H18N2.C11H15NO.C10H15NO2S.C10H15NS.C10H15N/c1-17(2,3)15-8-9-16(18-14-15)20-13-7-12-19-10-5-4-6-11-19;1-15(2,3)13-4-5-14(16-12-13)19-11-8-17-6-9-18-10-7-17;1-13(2,3)9-4-7-11(14-8-9)12(16)15-10-5-6-10;1-13(2,3)11-6-7-12(14-10-11)15-8-4-5-9-15;1-5-13-11(15)10-7-6-9(8-14-10)12(2,3)4;1-11(2,3)8-5-6-9(13-7-8)10(14)12-4;1-8(14)13-10-6-5-9(7-12-10)11(2,3)4;1-11(2,3)9-6-7-10(12-8-9)13(4)5;1-8(13)10-6-5-9(7-12-10)11(2,3)4;1-10(2,3)8-5-9(7-11-6-8)14(4,12)13;1-10(2,3)8-5-6-9(12-4)11-7-8;1-8-5-6-9(7-11-8)10(2,3)4/h8-9,14H,4-7,10-13H2,1-3H3;4-5,12H,6-11H2,1-3H3;4,7-8,10H,5-6H2,1-3H3,(H,15,16);6-7,10H,4-5,8-9H2,1-3H3;6-8H,5H2,1-4H3,(H,13,15);5-7H,1-4H3,(H,12,14);5-7H,1-4H3,(H,12,13,14);6-8H,1-5H3;5-7H,1-4H3;5-7H,1-4H3;5-7H,1-4H3;5-7H,1-4H3
InChIKeyGWXVQSJCOJVQNU-UHFFFAOYSA-N
MW2453.59 g/mol
LogP29.78
Rot. Bonds20

About 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine

5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine (PubChem CID 158390738) has the molecular formula C144H218N20O10S2 and a molecular weight of 2453.59 g/mol. Its IUPAC name is 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound Name5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine
PubChem CID158390738
Molecular FormulaC144H218N20O10S2
Molecular Weight2453.59 g/mol
Exact Mass2451.66
IUPAC Name5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine
SMILESCC(=O)Nc1ccc(C(C)(C)C)cn1.CC(=O)c1ccc(C(C)(C)C)cn1.CC(C)(C)c1ccc(C(=O)NC2CC2)nc1.CC(C)(C)c1ccc(N2CCCC2)nc1.CC(C)(C)c1ccc(OCCCN2CCCCC2)nc1.CC(C)(C)c1ccc(OCCN2CCOCC2)nc1.CC(C)(C)c1cncc(S(C)(=O)=O)c1.CCNC(=O)c1ccc(C(C)(C)C)cn1.CN(C)c1ccc(C(C)(C)C)cn1.CNC(=O)c1ccc(C(C)(C)C)cn1.CSc1ccc(C(C)(C)C)cn1.Cc1ccc(C(C)(C)C)cn1
InChIInChI=1S/C17H28N2O.C15H24N2O2.C13H18N2O.C13H20N2.C12H18N2O.2C11H16N2O.C11H18N2.C11H15NO.C10H15NO2S.C10H15NS.C10H15N/c1-17(2,3)15-8-9-16(18-14-15)20-13-7-12-19-10-5-4-6-11-19;1-15(2,3)13-4-5-14(16-12-13)19-11-8-17-6-9-18-10-7-17;1-13(2,3)9-4-7-11(14-8-9)12(16)15-10-5-6-10;1-13(2,3)11-6-7-12(14-10-11)15-8-4-5-9-15;1-5-13-11(15)10-7-6-9(8-14-10)12(2,3)4;1-11(2,3)8-5-6-9(13-7-8)10(14)12-4;1-8(14)13-10-6-5-9(7-12-10)11(2,3)4;1-11(2,3)9-6-7-10(12-8-9)13(4)5;1-8(13)10-6-5-9(7-12-10)11(2,3)4;1-10(2,3)8-5-9(7-11-6-8)14(4,12)13;1-10(2,3)8-5-6-9(12-4)11-7-8;1-8-5-6-9(7-11-8)10(2,3)4/h8-9,14H,4-7,10-13H2,1-3H3;4-5,12H,6-11H2,1-3H3;4,7-8,10H,5-6H2,1-3H3,(H,15,16);6-7,10H,4-5,8-9H2,1-3H3;6-8H,5H2,1-4H3,(H,13,15);5-7H,1-4H3,(H,12,14);5-7H,1-4H3,(H,12,13,14);6-8H,1-5H3;5-7H,1-4H3;5-7H,1-4H3;5-7H,1-4H3;5-7H,1-4H3
InChIKeyGWXVQSJCOJVQNU-UHFFFAOYSA-N
XLogP29.78
TPSA362.94 Ų
H-Bond Donors4
H-Bond Acceptors27
Rotatable Bonds20
Heavy Atoms176
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002453.59
LogP ≤ 529.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

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

Analyze 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine?
The IUPAC name of 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine (CID 158390738) is 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine.
What is the SMILES notation for 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine?
The canonical SMILES for 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine is CC(=O)Nc1ccc(C(C)(C)C)cn1.CC(=O)c1ccc(C(C)(C)C)cn1.CC(C)(C)c1ccc(C(=O)NC2CC2)nc1.CC(C)(C)c1ccc(N2CCCC2)nc1.CC(C)(C)c1ccc(OCCCN2CCCCC2)nc1.CC(C)(C)c1ccc(OCCN2CCOCC2)nc1.CC(C)(C)c1cncc(S(C)(=O)=O)c1.CCNC(=O)c1ccc(C(C)(C)C)cn1.CN(C)c1ccc(C(C)(C)C)cn1.CNC(=O)c1ccc(C(C)(C)C)cn1.CSc1ccc(C(C)(C)C)cn1.Cc1ccc(C(C)(C)C)cn1.
What is the InChIKey of 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine?
The InChIKey is GWXVQSJCOJVQNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O.C15H24N2O2.C13H18N2O.C13H20N2.C12H18N2O.2C11H16N2O.C11H18N2.C11H15NO.C10H15NO2S.C10H15NS.C10H15N/c1-17(2,3)15-8-9-16(18-14-15)20-13-7-12-19-10-5-4-6-11-19;1-15(2,3)13-4-5-14(16-12-13)19-11-8-17-6-9-18-10-7-17;1-13(2,3)9-4-7-11(14-8-9)12(16)15-10-5-6-10;1-13(2,3)11-6-7-12(14-10-11)15-8-4-5-9-15;1-5-13-11(15)10-7-6-9(8-14-10)12(2,3)4;1-11(2,3)8-5-6-9(13-7-8)10(14)12-4;1-8(14)13-10-6-5-9(7-12-10)11(2,3)4;1-11(2,3)9-6-7-10(12-8-9)13(4)5;1-8(13)10-6-5-9(7-12-10)11(2,3)4;1-10(2,3)8-5-9(7-11-6-8)14(4,12)13;1-10(2,3)8-5-6-9(12-4)11-7-8;1-8-5-6-9(7-11-8)10(2,3)4/h8-9,14H,4-7,10-13H2,1-3H3;4-5,12H,6-11H2,1-3H3;4,7-8,10H,5-6H2,1-3H3,(H,15,16);6-7,10H,4-5,8-9H2,1-3H3;6-8H,5H2,1-4H3,(H,13,15);5-7H,1-4H3,(H,12,14);5-7H,1-4H3,(H,12,13,14);6-8H,1-5H3;5-7H,1-4H3;5-7H,1-4H3;5-7H,1-4H3;5-7H,1-4H3.
What are the key properties of 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine?
5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine has a molecular weight of 2453.59 g/mol, XLogP of 29.78, 20 rotatable bonds, 4 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-N-cyclopropylpyridine-2-carboxamide;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-N-ethylpyridine-2-carboxamide;5-tert-butyl-2-methylpyridine;5-tert-butyl-N-methylpyridine-2-carboxamide;5-tert-butyl-2-methylsulfanylpyridine;3-tert-butyl-5-methylsulfonylpyridine;5-tert-butyl-2-(3-piperidin-1-ylpropoxy)pyridine;N-(5-tert-butyl-2-pyridinyl)acetamide;1-(5-tert-butyl-2-pyridinyl)ethanone;4-[2-[(5-tert-butyl-2-pyridinyl)oxy]ethyl]morpholine;5-tert-butyl-2-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 158390738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).