1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide

C17H28N4O — CID 99855067

IUPAC1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide
SMILESCc1cnc(C)c(N2CCC(C(=O)N[C@H](C)C(C)C)CC2)n1
InChIInChI=1S/C17H28N4O/c1-11(2)13(4)20-17(22)15-6-8-21(9-7-15)16-14(5)18-10-12(3)19-16/h10-11,13,15H,6-9H2,1-5H3,(H,20,22)/t13-/m1/s1
InChIKeyUAWVTLZQUBQIIG-CYBMUJFWSA-N
MW304.44 g/mol
LogP2.47
Rot. Bonds4

About 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide

1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide (PubChem CID 99855067) has the molecular formula C17H28N4O and a molecular weight of 304.44 g/mol. Its IUPAC name is 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide
PubChem CID99855067
Molecular FormulaC17H28N4O
Molecular Weight304.44 g/mol
Exact Mass304.23
IUPAC Name1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide
SMILESCc1cnc(C)c(N2CCC(C(=O)N[C@H](C)C(C)C)CC2)n1
InChIInChI=1S/C17H28N4O/c1-11(2)13(4)20-17(22)15-6-8-21(9-7-15)16-14(5)18-10-12(3)19-16/h10-11,13,15H,6-9H2,1-5H3,(H,20,22)/t13-/m1/s1
InChIKeyUAWVTLZQUBQIIG-CYBMUJFWSA-N
XLogP2.47
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide with MolForge

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Related Compounds

N-(3-methylbutan-2-yl)-1-(6-methylpyrazin-2-yl)piperidine-4-carboxamide
CID 133469352
1-(3,6-dimethylpyrazin-2-yl)pyrrolidine-3-carboxamide
CID 133470261
1-(3,6-dimethylpyrazin-2-yl)-N,N-diethylpiperidine-4-carboxamide
CID 133469139
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(3-methylbutan-2-yl)piperidine-4-carboxamide
CID 51153994
3-[4-(1-chloroethyl)piperidin-1-yl]-2,5-dimethylpyrazine
CID 106838567
cyclohexyl-[4-(3,6-dimethylpyrazin-2-yl)piperazin-1-yl]methanone
CID 133468891
2,5-dimethyl-3-[4-(1-pyrrolidin-1-ylethyl)piperidin-1-yl]pyrazine
CID 70724831
1-(3,6-dimethylpyrazin-2-yl)piperidine-4-carbaldehyde
CID 65419285
ethyl 5-methyl-4-[4-[[(2R)-3-methylbutan-2-yl]carbamoyl]piperidin-1-yl]thieno[2,3-d]pyrimidine-6-carboxylate
CID 97029215
3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl-[1-(3,6-dimethylpyrazin-2-yl)pyrrolidin-3-yl]methanone
CID 175648087
1-(1,3-benzoxazol-2-yl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide
CID 17456772
1-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-propan-2-ylpiperidine-4-carboxamide
CID 171992682

Frequently Asked Questions

What is the IUPAC name of 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide?
The IUPAC name of 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide (CID 99855067) is 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide is Cc1cnc(C)c(N2CCC(C(=O)N[C@H](C)C(C)C)CC2)n1.
What is the InChIKey of 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide?
The InChIKey is UAWVTLZQUBQIIG-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H28N4O/c1-11(2)13(4)20-17(22)15-6-8-21(9-7-15)16-14(5)18-10-12(3)19-16/h10-11,13,15H,6-9H2,1-5H3,(H,20,22)/t13-/m1/s1.
What are the key properties of 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide?
1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide has a molecular weight of 304.44 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,6-dimethylpyrazin-2-yl)-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide is sourced from PubChem (CID 99855067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).