2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide

C16H22N8O2 — CID 90621314

IUPAC2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide
SMILESO=C(Cn1nnc(N2CCOCC2)n1)NC1CCN(c2ccccn2)C1
InChIInChI=1S/C16H22N8O2/c25-15(12-24-20-16(19-21-24)22-7-9-26-10-8-22)18-13-4-6-23(11-13)14-3-1-2-5-17-14/h1-3,5,13H,4,6-12H2,(H,18,25)
InChIKeyAETCJNCQIJMKAA-UHFFFAOYSA-N
MW358.41 g/mol
LogP-0.70
Rot. Bonds5

About 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide

2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide (PubChem CID 90621314) has the molecular formula C16H22N8O2 and a molecular weight of 358.41 g/mol. Its IUPAC name is 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide
PubChem CID90621314
Molecular FormulaC16H22N8O2
Molecular Weight358.41 g/mol
Exact Mass358.19
IUPAC Name2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide
SMILESO=C(Cn1nnc(N2CCOCC2)n1)NC1CCN(c2ccccn2)C1
InChIInChI=1S/C16H22N8O2/c25-15(12-24-20-16(19-21-24)22-7-9-26-10-8-22)18-13-4-6-23(11-13)14-3-1-2-5-17-14/h1-3,5,13H,4,6-12H2,(H,18,25)
InChIKeyAETCJNCQIJMKAA-UHFFFAOYSA-N
XLogP-0.70
TPSA101.30 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.41
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

2-indol-1-yl-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]acetamide
CID 99697341
2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide
CID 166181192
ethane;1-methyl-3-(1-pyridin-2-ylpyrrolidin-3-yl)urea
CID 91102074
3-cyclohexyl-N-(1-pyridin-2-ylpyrrolidin-3-yl)propanamide
CID 90621185
2-(1-hydroxycyclohexyl)-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]acetamide
CID 97241202
2-(4-acetamidophenyl)-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]acetamide
CID 99696681
4-phenyl-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]oxane-4-carboxamide
CID 99819338
3-(3,4-dichlorophenyl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)propanamide
CID 90621285
N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]benzamide
CID 99697085
3-hydroxy-3-phenyl-N-(1-pyridin-2-ylpyrrolidin-3-yl)butanamide
CID 110026123
2-(2-methylimidazol-1-yl)-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124958753
N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
CID 75446101

Frequently Asked Questions

What is the IUPAC name of 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide?
The IUPAC name of 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide (CID 90621314) is 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide?
The canonical SMILES for 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide is O=C(Cn1nnc(N2CCOCC2)n1)NC1CCN(c2ccccn2)C1.
What is the InChIKey of 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide?
The InChIKey is AETCJNCQIJMKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N8O2/c25-15(12-24-20-16(19-21-24)22-7-9-26-10-8-22)18-13-4-6-23(11-13)14-3-1-2-5-17-14/h1-3,5,13H,4,6-12H2,(H,18,25).
What are the key properties of 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide?
2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide has a molecular weight of 358.41 g/mol, XLogP of -0.70, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide is sourced from PubChem (CID 90621314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).