N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide

C18H26N4O3 — CID 166354866

IUPACN-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide
SMILESCC(=O)NC1CC(C2CCN(C(=O)c3cnc(OC(C)C)cn3)C2)C1
InChIInChI=1S/C18H26N4O3/c1-11(2)25-17-9-19-16(8-20-17)18(24)22-5-4-13(10-22)14-6-15(7-14)21-12(3)23/h8-9,11,13-15H,4-7,10H2,1-3H3,(H,21,23)
InChIKeyDWPCYHNFVZUTQB-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.64
Rot. Bonds5

About N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide

N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide (PubChem CID 166354866) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide
PubChem CID166354866
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC NameN-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide
SMILESCC(=O)NC1CC(C2CCN(C(=O)c3cnc(OC(C)C)cn3)C2)C1
InChIInChI=1S/C18H26N4O3/c1-11(2)25-17-9-19-16(8-20-17)18(24)22-5-4-13(10-22)14-6-15(7-14)21-12(3)23/h8-9,11,13-15H,4-7,10H2,1-3H3,(H,21,23)
InChIKeyDWPCYHNFVZUTQB-UHFFFAOYSA-N
XLogP1.64
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(5-aminopyrazin-2-yl)-[(3R,4S)-3-fluoro-4-propan-2-yloxypiperidin-1-yl]methanone
CID 121261843
propan-2-yl 3-acetamidopyrrolidine-1-carboxylate
CID 77434024
[1-(5-propan-2-yloxypyrazine-2-carbonyl)piperidin-2-yl]methyl N-methylcarbamate
CID 126813332
5-(1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carbonyl)pyrazine-2-carboxylic acid
CID 120689040
N-[3-[1-[5-(hydroxymethyl)-3-methylfuran-2-carbonyl]pyrrolidin-3-yl]cyclobutyl]acetamide
CID 166355098
1-[4-(5-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone
CID 103803140
[3-(1-hydroxyethyl)pyrrolidin-1-yl]-[5-(propylamino)pyrazin-2-yl]methanone
CID 107376688
(4-hydroxypiperidin-1-yl)-(6-propan-2-yloxy-3-pyridinyl)methanone
CID 110890106
(6S)-1-acetyl-N-methyl-4-(5-methylpyrazine-2-carbonyl)-1,4-diazepane-6-carboxamide
CID 124945127
[3-(methylaminomethyl)pyrrolidin-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 63264092
(3,5-dimethylpiperidin-1-yl)-(5-methylpyrazin-2-yl)methanone
CID 42910146
(3R)-N-cyclopropyl-1-[1-(5-methylpyrazine-2-carbonyl)piperidin-4-yl]piperidine-3-carboxamide
CID 95549906

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide?
The IUPAC name of N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide (CID 166354866) is N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide.
What is the SMILES notation for N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide?
The canonical SMILES for N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide is CC(=O)NC1CC(C2CCN(C(=O)c3cnc(OC(C)C)cn3)C2)C1.
What is the InChIKey of N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide?
The InChIKey is DWPCYHNFVZUTQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-11(2)25-17-9-19-16(8-20-17)18(24)22-5-4-13(10-22)14-6-15(7-14)21-12(3)23/h8-9,11,13-15H,4-7,10H2,1-3H3,(H,21,23).
What are the key properties of N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide?
N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide has a molecular weight of 346.43 g/mol, XLogP of 1.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-(5-propan-2-yloxypyrazine-2-carbonyl)pyrrolidin-3-yl]cyclobutyl]acetamide is sourced from PubChem (CID 166354866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).