3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide

C17H24N2O2 — CID 18988176

IUPAC3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide
SMILESCOc1cccc(C(=O)NC2CC3CCC(C2)N3C)c1C
InChIInChI=1S/C17H24N2O2/c1-11-15(5-4-6-16(11)21-3)17(20)18-12-9-13-7-8-14(10-12)19(13)2/h4-6,12-14H,7-10H2,1-3H3,(H,18,20)
InChIKeyLFDKCGBGVAEEKP-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.36
Rot. Bonds3

About 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide

3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide (PubChem CID 18988176) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide.

Molecular Properties

Compound Name3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide
PubChem CID18988176
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide
SMILESCOc1cccc(C(=O)NC2CC3CCC(C2)N3C)c1C
InChIInChI=1S/C17H24N2O2/c1-11-15(5-4-6-16(11)21-3)17(20)18-12-9-13-7-8-14(10-12)19(13)2/h4-6,12-14H,7-10H2,1-3H3,(H,18,20)
InChIKeyLFDKCGBGVAEEKP-UHFFFAOYSA-N
XLogP2.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dimethoxy-N-[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]benzamide
CID 13053662
N-[(3S,7R,8aS)-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-7-yl]-3-methoxy-2-methylbenzamide
CID 155500497
2-methoxy-N-[[(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]carbamoyl]benzamide
CID 15751470
3-methoxy-2-methyl-N-[8-[1-[3-(4-methylpiperazin-1-yl)propyl]-2H-pyridin-2-yl]-8-azabicyclo[3.2.1]octan-3-yl]benzamide
CID 67403571
6-[(1R,5S)-3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]octan-8-yl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 67403403
N-[1-(3,4-dimethoxyphenyl)ethyl]-6-[(1R,5S)-3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]octan-8-yl]pyridine-3-carboxamide
CID 67404604
(2S)-2-[[6-[(1R,5S)-3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]octan-8-yl]pyridine-3-carbonyl]amino]-2-(4-methoxyphenyl)acetic acid
CID 67403838
6-[(1R,5S)-3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]octan-8-yl]-N-[(1S)-1-(3-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 67404428
N-[(4-fluorophenyl)methyl]-6-[3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]octan-8-yl]pyridine-3-carboxamide
CID 25271239
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2-methoxybenzamide;hydrochloride
CID 3059281
6-[(1R,5S)-3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]octan-8-yl]-N-(3-propoxypropyl)pyridine-3-carboxamide
CID 67402803
N-[(4-chlorophenyl)methyl]-6-[(1R,5S)-3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]octan-8-yl]pyridine-3-carboxamide
CID 67404042

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide?
The IUPAC name of 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide (CID 18988176) is 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide.
What is the SMILES notation for 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide?
The canonical SMILES for 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide is COc1cccc(C(=O)NC2CC3CCC(C2)N3C)c1C.
What is the InChIKey of 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide?
The InChIKey is LFDKCGBGVAEEKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-11-15(5-4-6-16(11)21-3)17(20)18-12-9-13-7-8-14(10-12)19(13)2/h4-6,12-14H,7-10H2,1-3H3,(H,18,20).
What are the key properties of 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide?
3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide has a molecular weight of 288.39 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide is sourced from PubChem (CID 18988176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).