5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide

C26H30N4O3 — CID 71526314

IUPAC5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide
SMILESCc1oc(-c2ccccc2)nc1CC(C)(C)NC(=O)c1cnc(C2CC2)c(OCC2CC2)n1
InChIInChI=1S/C26H30N4O3/c1-16-20(28-24(33-16)19-7-5-4-6-8-19)13-26(2,3)30-23(31)21-14-27-22(18-11-12-18)25(29-21)32-15-17-9-10-17/h4-8,14,17-18H,9-13,15H2,1-3H3,(H,30,31)
InChIKeyAZQKAAQZZQJMHN-UHFFFAOYSA-N
MW446.55 g/mol
LogP4.86
Rot. Bonds9

About 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide

5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide (PubChem CID 71526314) has the molecular formula C26H30N4O3 and a molecular weight of 446.55 g/mol. Its IUPAC name is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide
PubChem CID71526314
Molecular FormulaC26H30N4O3
Molecular Weight446.55 g/mol
Exact Mass446.23
IUPAC Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide
SMILESCc1oc(-c2ccccc2)nc1CC(C)(C)NC(=O)c1cnc(C2CC2)c(OCC2CC2)n1
InChIInChI=1S/C26H30N4O3/c1-16-20(28-24(33-16)19-7-5-4-6-8-19)13-26(2,3)30-23(31)21-14-27-22(18-11-12-18)25(29-21)32-15-17-9-10-17/h4-8,14,17-18H,9-13,15H2,1-3H3,(H,30,31)
InChIKeyAZQKAAQZZQJMHN-UHFFFAOYSA-N
XLogP4.86
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.55
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide?
The IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide (CID 71526314) is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide?
The canonical SMILES for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide is Cc1oc(-c2ccccc2)nc1CC(C)(C)NC(=O)c1cnc(C2CC2)c(OCC2CC2)n1.
What is the InChIKey of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide?
The InChIKey is AZQKAAQZZQJMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N4O3/c1-16-20(28-24(33-16)19-7-5-4-6-8-19)13-26(2,3)30-23(31)21-14-27-22(18-11-12-18)25(29-21)32-15-17-9-10-17/h4-8,14,17-18H,9-13,15H2,1-3H3,(H,30,31).
What are the key properties of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide?
5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide has a molecular weight of 446.55 g/mol, XLogP of 4.86, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)propan-2-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 71526314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).