2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide

C20H29N3O — CID 119888772

IUPAC2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide
SMILESO=C(CC1CC2CCC(C1)N2)NC1CCCN(c2ccccc2)C1
InChIInChI=1S/C20H29N3O/c24-20(13-15-11-16-8-9-17(12-15)21-16)22-18-5-4-10-23(14-18)19-6-2-1-3-7-19/h1-3,6-7,15-18,21H,4-5,8-14H2,(H,22,24)
InChIKeyQQKROBQNKWVDDL-UHFFFAOYSA-N
MW327.47 g/mol
LogP2.69
Rot. Bonds4

About 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide (PubChem CID 119888772) has the molecular formula C20H29N3O and a molecular weight of 327.47 g/mol. Its IUPAC name is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide
PubChem CID119888772
Molecular FormulaC20H29N3O
Molecular Weight327.47 g/mol
Exact Mass327.23
IUPAC Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide
SMILESO=C(CC1CC2CCC(C1)N2)NC1CCCN(c2ccccc2)C1
InChIInChI=1S/C20H29N3O/c24-20(13-15-11-16-8-9-17(12-15)21-16)22-18-5-4-10-23(14-18)19-6-2-1-3-7-19/h1-3,6-7,15-18,21H,4-5,8-14H2,(H,22,24)
InChIKeyQQKROBQNKWVDDL-UHFFFAOYSA-N
XLogP2.69
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.47
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(3-methoxyphenyl)piperidin-3-yl]acetamide;dihydrochloride
CID 119884229
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]acetamide
CID 119884012
[(3R)-1-phenylpiperidin-3-yl]carbamic acid
CID 89499357
3-amino-N-(1-phenylpiperidin-3-yl)butanamide
CID 119888787
(1-phenylpiperidin-3-yl)urea
CID 121416777
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-cycloheptylacetamide
CID 79607418
4-(methylamino)-N-(1-phenylpiperidin-3-yl)butanamide
CID 119888744
2-(8-azabicyclo[3.2.1]octan-3-yl)-1-(4-phenyl-1,4-diazepan-1-yl)ethanone;dihydrochloride
CID 119860795
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(azepan-1-yl)phenyl]acetamide;dihydrochloride
CID 119842083
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-piperidin-1-ylphenyl)acetamide;dihydrochloride
CID 119828036
2-[methyl(propan-2-yl)amino]-N-(1-phenylpiperidin-3-yl)acetamide
CID 136526077
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide;dihydrochloride
CID 119840334

Frequently Asked Questions

What is the IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide?
The IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide (CID 119888772) is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide is O=C(CC1CC2CCC(C1)N2)NC1CCCN(c2ccccc2)C1.
What is the InChIKey of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide?
The InChIKey is QQKROBQNKWVDDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O/c24-20(13-15-11-16-8-9-17(12-15)21-16)22-18-5-4-10-23(14-18)19-6-2-1-3-7-19/h1-3,6-7,15-18,21H,4-5,8-14H2,(H,22,24).
What are the key properties of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide?
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide has a molecular weight of 327.47 g/mol, XLogP of 2.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-phenylpiperidin-3-yl)acetamide is sourced from PubChem (CID 119888772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).