N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide

C15H21N3O — CID 10467752

IUPACN-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide
SMILESCC1CCC(NC(=O)c2cnc3c(n2)CCC3)CC1
InChIInChI=1S/C15H21N3O/c1-10-5-7-11(8-6-10)17-15(19)14-9-16-12-3-2-4-13(12)18-14/h9-11H,2-8H2,1H3,(H,17,19)
InChIKeyFYEMTDOCAZIVGB-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.27
Rot. Bonds2

About N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide

N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide (PubChem CID 10467752) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide
PubChem CID10467752
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide
SMILESCC1CCC(NC(=O)c2cnc3c(n2)CCC3)CC1
InChIInChI=1S/C15H21N3O/c1-10-5-7-11(8-6-10)17-15(19)14-9-16-12-3-2-4-13(12)18-14/h9-11H,2-8H2,1H3,(H,17,19)
InChIKeyFYEMTDOCAZIVGB-UHFFFAOYSA-N
XLogP2.27
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide?
The IUPAC name of N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide (CID 10467752) is N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide?
The canonical SMILES for N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide is CC1CCC(NC(=O)c2cnc3c(n2)CCC3)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide?
The InChIKey is FYEMTDOCAZIVGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-10-5-7-11(8-6-10)17-15(19)14-9-16-12-3-2-4-13(12)18-14/h9-11H,2-8H2,1H3,(H,17,19).
What are the key properties of N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide?
N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide has a molecular weight of 259.35 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-6,7-dihydro-5H-cyclopenta[b]pyrazine-3-carboxamide is sourced from PubChem (CID 10467752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).