N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide

C15H24N4O2 — CID 138036675

IUPACN-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide
SMILESCC(C)Oc1cnc(C(=O)NC[C@@H]2CC[C@H](C)N2C)cn1
InChIInChI=1S/C15H24N4O2/c1-10(2)21-14-9-16-13(8-17-14)15(20)18-7-12-6-5-11(3)19(12)4/h8-12H,5-7H2,1-4H3,(H,18,20)/t11-,12-/m0/s1
InChIKeyKEHKFWNWNAGHAM-RYUDHWBXSA-N
MW292.38 g/mol
LogP1.48
Rot. Bonds5

About N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide

N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide (PubChem CID 138036675) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide
PubChem CID138036675
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide
SMILESCC(C)Oc1cnc(C(=O)NC[C@@H]2CC[C@H](C)N2C)cn1
InChIInChI=1S/C15H24N4O2/c1-10(2)21-14-9-16-13(8-17-14)15(20)18-7-12-6-5-11(3)19(12)4/h8-12H,5-7H2,1-4H3,(H,18,20)/t11-,12-/m0/s1
InChIKeyKEHKFWNWNAGHAM-RYUDHWBXSA-N
XLogP1.48
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide?
The IUPAC name of N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide (CID 138036675) is N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide.
What is the SMILES notation for N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide?
The canonical SMILES for N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide is CC(C)Oc1cnc(C(=O)NC[C@@H]2CC[C@H](C)N2C)cn1.
What is the InChIKey of N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide?
The InChIKey is KEHKFWNWNAGHAM-RYUDHWBXSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-10(2)21-14-9-16-13(8-17-14)15(20)18-7-12-6-5-11(3)19(12)4/h8-12H,5-7H2,1-4H3,(H,18,20)/t11-,12-/m0/s1.
What are the key properties of N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide?
N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S,5S)-1,5-dimethylpyrrolidin-2-yl]methyl]-5-propan-2-yloxypyrazine-2-carboxamide is sourced from PubChem (CID 138036675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).