2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide

C79H121N15O — CID 157268176

IUPAC2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide
SMILESC=C(C)N1CCC(C)CC1.CC1CCN(C(=O)N(C)C)CC1.CC1CCN(c2ccccn2)C1.CC1CCN(c2ccccn2)CC1.CC1CCN(c2ccncc2)CC1.CCN1CCC(c2ccc[nH]2)CC1.Cc1ccccn1.Cc1ccccn1.Cc1cnc(C)cn1
InChIInChI=1S/2C11H16N2.C11H18N2.C10H14N2.C9H18N2O.C9H17N.C6H8N2.2C6H7N/c1-10-4-8-13(9-5-10)11-2-6-12-7-3-11;1-10-5-8-13(9-6-10)11-4-2-3-7-12-11;1-2-13-8-5-10(6-9-13)11-4-3-7-12-11;1-9-5-7-12(8-9)10-4-2-3-6-11-10;1-8-4-6-11(7-5-8)9(12)10(2)3;1-8(2)10-6-4-9(3)5-7-10;1-5-3-8-6(2)4-7-5;2*1-6-4-2-3-5-7-6/h2-3,6-7,10H,4-5,8-9H2,1H3;2-4,7,10H,5-6,8-9H2,1H3;3-4,7,10,12H,2,5-6,8-9H2,1H3;2-4,6,9H,5,7-8H2,1H3;8H,4-7H2,1-3H3;9H,1,4-7H2,2-3H3;3-4H,1-2H3;2*2-5H,1H3
InChIKeyAYFQODZQEDZQGD-UHFFFAOYSA-N
MW1296.94 g/mol
LogP16.30
Rot. Bonds6

About 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide

2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide (PubChem CID 157268176) has the molecular formula C79H121N15O and a molecular weight of 1296.94 g/mol. Its IUPAC name is 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide
PubChem CID157268176
Molecular FormulaC79H121N15O
Molecular Weight1296.94 g/mol
Exact Mass1295.99
IUPAC Name2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide
SMILESC=C(C)N1CCC(C)CC1.CC1CCN(C(=O)N(C)C)CC1.CC1CCN(c2ccccn2)C1.CC1CCN(c2ccccn2)CC1.CC1CCN(c2ccncc2)CC1.CCN1CCC(c2ccc[nH]2)CC1.Cc1ccccn1.Cc1ccccn1.Cc1cnc(C)cn1
InChIInChI=1S/2C11H16N2.C11H18N2.C10H14N2.C9H18N2O.C9H17N.C6H8N2.2C6H7N/c1-10-4-8-13(9-5-10)11-2-6-12-7-3-11;1-10-5-8-13(9-6-10)11-4-2-3-7-12-11;1-2-13-8-5-10(6-9-13)11-4-3-7-12-11;1-9-5-7-12(8-9)10-4-2-3-6-11-10;1-8-4-6-11(7-5-8)9(12)10(2)3;1-8(2)10-6-4-9(3)5-7-10;1-5-3-8-6(2)4-7-5;2*1-6-4-2-3-5-7-6/h2-3,6-7,10H,4-5,8-9H2,1H3;2-4,7,10H,5-6,8-9H2,1H3;3-4,7,10,12H,2,5-6,8-9H2,1H3;2-4,6,9H,5,7-8H2,1H3;8H,4-7H2,1-3H3;9H,1,4-7H2,2-3H3;3-4H,1-2H3;2*2-5H,1H3
InChIKeyAYFQODZQEDZQGD-UHFFFAOYSA-N
XLogP16.30
TPSA145.77 Ų
H-Bond Donors1
H-Bond Acceptors13
Rotatable Bonds6
Heavy Atoms95
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001296.94
LogP ≤ 516.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1013

Analyze 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide with MolForge

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Related Compounds

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CID 92045130
4-N-methyl-6-(2-piperazin-1-yl-4-pyridinyl)-2-N-pyrazin-2-ylpyridine-2,4-diamine
CID 56948749
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CID 66836906
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CID 67127837
N-[2-(2-piperazin-1-yl-4-pyridinyl)-6-(pyrazin-2-ylamino)-4-pyridinyl]-2-pyridin-3-ylacetamide
CID 67128018
N-[4-[3-(6-methyl-2-pyridinyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]-2-pyridinyl]acetamide
CID 121411862
N-[4-[3-(5-methyl-2-pyridinyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]-2-pyridinyl]acetamide
CID 121412028
US11111247, Example 9
CID 146448849
4-[8-[6-(dimethylamino)-3-pyridinyl]-3-methyl-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]-N-methylpiperidine-1-carboxamide
CID 58379488
8-[6-(Dimethylamino)-3-pyridinyl]-3-methyl-1-piperidin-4-ylimidazo[4,5-c][1,5]naphthyridin-2-one
CID 58379515
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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide?
The IUPAC name of 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide (CID 157268176) is 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide.
What is the SMILES notation for 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide?
The canonical SMILES for 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide is C=C(C)N1CCC(C)CC1.CC1CCN(C(=O)N(C)C)CC1.CC1CCN(c2ccccn2)C1.CC1CCN(c2ccccn2)CC1.CC1CCN(c2ccncc2)CC1.CCN1CCC(c2ccc[nH]2)CC1.Cc1ccccn1.Cc1ccccn1.Cc1cnc(C)cn1.
What is the InChIKey of 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide?
The InChIKey is AYFQODZQEDZQGD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H16N2.C11H18N2.C10H14N2.C9H18N2O.C9H17N.C6H8N2.2C6H7N/c1-10-4-8-13(9-5-10)11-2-6-12-7-3-11;1-10-5-8-13(9-6-10)11-4-2-3-7-12-11;1-2-13-8-5-10(6-9-13)11-4-3-7-12-11;1-9-5-7-12(8-9)10-4-2-3-6-11-10;1-8-4-6-11(7-5-8)9(12)10(2)3;1-8(2)10-6-4-9(3)5-7-10;1-5-3-8-6(2)4-7-5;2*1-6-4-2-3-5-7-6/h2-3,6-7,10H,4-5,8-9H2,1H3;2-4,7,10H,5-6,8-9H2,1H3;3-4,7,10,12H,2,5-6,8-9H2,1H3;2-4,6,9H,5,7-8H2,1H3;8H,4-7H2,1-3H3;9H,1,4-7H2,2-3H3;3-4H,1-2H3;2*2-5H,1H3.
What are the key properties of 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide?
2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide has a molecular weight of 1296.94 g/mol, XLogP of 16.30, 6 rotatable bonds, 1 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpyrazine;1-ethyl-4-(1H-pyrrol-2-yl)piperidine;2-(4-methylpiperidin-1-yl)pyridine;4-(4-methylpiperidin-1-yl)pyridine;4-methyl-1-prop-1-en-2-ylpiperidine;bis(2-methylpyridine);2-(3-methylpyrrolidin-1-yl)pyridine;N,N,4-trimethylpiperidine-1-carboxamide is sourced from PubChem (CID 157268176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).