4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide

C20H23N3O2 — CID 167911836

IUPAC4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide
SMILESO=C(NCCc1ccccn1)c1ccc(N2CC3CCC(C2)O3)cc1
InChIInChI=1S/C20H23N3O2/c24-20(22-12-10-16-3-1-2-11-21-16)15-4-6-17(7-5-15)23-13-18-8-9-19(14-23)25-18/h1-7,11,18-19H,8-10,12-14H2,(H,22,24)
InChIKeyFBIYQDQOJLMFHY-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.42
Rot. Bonds5

About 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide

4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide (PubChem CID 167911836) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound Name4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide
PubChem CID167911836
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide
SMILESO=C(NCCc1ccccn1)c1ccc(N2CC3CCC(C2)O3)cc1
InChIInChI=1S/C20H23N3O2/c24-20(22-12-10-16-3-1-2-11-21-16)15-4-6-17(7-5-15)23-13-18-8-9-19(14-23)25-18/h1-7,11,18-19H,8-10,12-14H2,(H,22,24)
InChIKeyFBIYQDQOJLMFHY-UHFFFAOYSA-N
XLogP2.42
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide with MolForge

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Related Compounds

6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 39898275
methyl 4-[[4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)benzoyl]amino]butanoate
CID 166318550
N-(2-pyridin-2-ylethyl)oxane-4-carboxamide
CID 51073128
4-hydroxy-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 112530288
N-(2-pyridin-2-ylethyl)cyclopentanecarboxamide
CID 110872250
3-(4-methylpiperidin-1-yl)-N-(2-pyridin-2-ylethyl)indolizine-6-carboxamide
CID 97407087
2-morpholin-4-yl-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 39897733
cis-(1R,3S)-3-(2-pyridin-2-ylethylcarbamoyl)cyclopentane-1-carboxylic acid
CID 74235631
N-(2-pyridin-2-ylethyl)-1H-indole-6-carboxamide
CID 22139228
2-(hydroxymethyl)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 115116136
ethyl 5-methyl-1-[4-(2-pyridin-2-ylethylcarbamoyl)phenyl]pyrazole-4-carboxylate
CID 46429346
3-amino-N-(2-pyridin-2-ylethyl)benzamide
CID 24704285

Frequently Asked Questions

What is the IUPAC name of 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide?
The IUPAC name of 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide (CID 167911836) is 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide.
What is the SMILES notation for 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide?
The canonical SMILES for 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide is O=C(NCCc1ccccn1)c1ccc(N2CC3CCC(C2)O3)cc1.
What is the InChIKey of 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide?
The InChIKey is FBIYQDQOJLMFHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c24-20(22-12-10-16-3-1-2-11-21-16)15-4-6-17(7-5-15)23-13-18-8-9-19(14-23)25-18/h1-7,11,18-19H,8-10,12-14H2,(H,22,24).
What are the key properties of 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide?
4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide has a molecular weight of 337.42 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-(2-pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 167911836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).