5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide

C23H30N4O2 — CID 71526315

IUPAC5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide
SMILESCC(CC(C)(C)NC(=O)c1cnc(C2CC2)c(OCC2CC2)n1)c1ccncc1
InChIInChI=1S/C23H30N4O2/c1-15(17-8-10-24-11-9-17)12-23(2,3)27-21(28)19-13-25-20(18-6-7-18)22(26-19)29-14-16-4-5-16/h8-11,13,15-16,18H,4-7,12,14H2,1-3H3,(H,27,28)
InChIKeyMPGISAUDRMGDDI-UHFFFAOYSA-N
MW394.52 g/mol
LogP4.24
Rot. Bonds9

About 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide

5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide (PubChem CID 71526315) has the molecular formula C23H30N4O2 and a molecular weight of 394.52 g/mol. Its IUPAC name is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide
PubChem CID71526315
Molecular FormulaC23H30N4O2
Molecular Weight394.52 g/mol
Exact Mass394.24
IUPAC Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide
SMILESCC(CC(C)(C)NC(=O)c1cnc(C2CC2)c(OCC2CC2)n1)c1ccncc1
InChIInChI=1S/C23H30N4O2/c1-15(17-8-10-24-11-9-17)12-23(2,3)27-21(28)19-13-25-20(18-6-7-18)22(26-19)29-14-16-4-5-16/h8-11,13,15-16,18H,4-7,12,14H2,1-3H3,(H,27,28)
InChIKeyMPGISAUDRMGDDI-UHFFFAOYSA-N
XLogP4.24
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide (CID 71526315) is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide is CC(CC(C)(C)NC(=O)c1cnc(C2CC2)c(OCC2CC2)n1)c1ccncc1.
What is the InChIKey of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide?
The InChIKey is MPGISAUDRMGDDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O2/c1-15(17-8-10-24-11-9-17)12-23(2,3)27-21(28)19-13-25-20(18-6-7-18)22(26-19)29-14-16-4-5-16/h8-11,13,15-16,18H,4-7,12,14H2,1-3H3,(H,27,28).
What are the key properties of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide?
5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide has a molecular weight of 394.52 g/mol, XLogP of 4.24, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-(2-methyl-4-pyridin-4-ylpentan-2-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 71526315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).