2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide

C14H18N4O3 — CID 141007627

IUPAC2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide
SMILESNC(=O)CN1CCC(CC(=O)NCc2ccccn2)C1=O
InChIInChI=1S/C14H18N4O3/c15-12(19)9-18-6-4-10(14(18)21)7-13(20)17-8-11-3-1-2-5-16-11/h1-3,5,10H,4,6-9H2,(H2,15,19)(H,17,20)
InChIKeyCQUJTTRBJSANED-UHFFFAOYSA-N
MW290.32 g/mol
LogP-0.58
Rot. Bonds6

About 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide

2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 141007627) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide
PubChem CID141007627
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide
SMILESNC(=O)CN1CCC(CC(=O)NCc2ccccn2)C1=O
InChIInChI=1S/C14H18N4O3/c15-12(19)9-18-6-4-10(14(18)21)7-13(20)17-8-11-3-1-2-5-16-11/h1-3,5,10H,4,6-9H2,(H2,15,19)(H,17,20)
InChIKeyCQUJTTRBJSANED-UHFFFAOYSA-N
XLogP-0.58
TPSA105.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 79333901
2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 110851953
2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 71985240
2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 108999232
1-[4-oxo-4-(pyridin-2-ylmethylamino)butanoyl]piperidine-4-carboxamide
CID 3485288
2-(1,1-dioxothiolan-3-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 86907941
2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 56803059
3-iodo-N-(pyridin-2-ylmethyl)propanamide
CID 163408162
2-[1-(4-methoxyphenyl)-2,5-dioxoimidazolidin-4-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 91821591
ethyl 2-[1-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]piperidin-2-yl]acetate
CID 56883612
2-(6,11-dioxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 78149585
2-[(2R)-1-(benzenesulfonyl)piperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 42065143

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide (CID 141007627) is 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide is NC(=O)CN1CCC(CC(=O)NCc2ccccn2)C1=O.
What is the InChIKey of 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is CQUJTTRBJSANED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c15-12(19)9-18-6-4-10(14(18)21)7-13(20)17-8-11-3-1-2-5-16-11/h1-3,5,10H,4,6-9H2,(H2,15,19)(H,17,20).
What are the key properties of 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide?
2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 290.32 g/mol, XLogP of -0.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-amino-2-oxoethyl)-2-oxopyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 141007627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).