N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide

C20H24N4O — CID 119870635

IUPACN-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide
SMILESO=C(CC1CC2CCC(C1)N2)Nc1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C20H24N4O/c25-20(12-14-10-16-6-7-17(11-14)22-16)24-18-8-9-19(21-13-18)23-15-4-2-1-3-5-15/h1-5,8-9,13-14,16-17,22H,6-7,10-12H2,(H,21,23)(H,24,25)
InChIKeyHEYRAJLJKAWEON-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.68
Rot. Bonds5

About N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide

N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide (PubChem CID 119870635) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide.

Molecular Properties

Compound NameN-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide
PubChem CID119870635
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC NameN-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide
SMILESO=C(CC1CC2CCC(C1)N2)Nc1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C20H24N4O/c25-20(12-14-10-16-6-7-17(11-14)22-16)24-18-8-9-19(21-13-18)23-15-4-2-1-3-5-15/h1-5,8-9,13-14,16-17,22H,6-7,10-12H2,(H,21,23)(H,24,25)
InChIKeyHEYRAJLJKAWEON-UHFFFAOYSA-N
XLogP3.68
TPSA66.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide;dihydrochloride
CID 119879379
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-chloro-2-pyridinyl)acetamide
CID 79607334
5-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]-2-chloro-N-phenylbenzamide;hydrochloride
CID 119789178
N-[3-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]phenyl]benzamide
CID 119709596
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide;dihydrochloride
CID 119839701
N-[4-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]phenyl]propanamide;hydrochloride
CID 119735821
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]acetamide
CID 119871387
N-(6-anilino-3-pyridinyl)-3-phenylpropanamide
CID 113016040
N-(3-acetylphenyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 79610778
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(3-pyrazol-1-ylphenyl)acetamide
CID 119708754
3-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]-N-methyl-N-phenylbenzamide
CID 119714267
N-[4-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]phenyl]-2-methylpropanamide
CID 119685267

Frequently Asked Questions

What is the IUPAC name of N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide?
The IUPAC name of N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide (CID 119870635) is N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide.
What is the SMILES notation for N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide?
The canonical SMILES for N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide is O=C(CC1CC2CCC(C1)N2)Nc1ccc(Nc2ccccc2)nc1.
What is the InChIKey of N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide?
The InChIKey is HEYRAJLJKAWEON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c25-20(12-14-10-16-6-7-17(11-14)22-16)24-18-8-9-19(21-13-18)23-15-4-2-1-3-5-15/h1-5,8-9,13-14,16-17,22H,6-7,10-12H2,(H,21,23)(H,24,25).
What are the key properties of N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide?
N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide has a molecular weight of 336.44 g/mol, XLogP of 3.68, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-anilino-3-pyridinyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide is sourced from PubChem (CID 119870635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).