3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide

C17H26N2O2 — CID 43187175

IUPAC3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide
SMILESCOc1cc(C(=O)N(C)CCC2CCCCN2)ccc1C
InChIInChI=1S/C17H26N2O2/c1-13-7-8-14(12-16(13)21-3)17(20)19(2)11-9-15-6-4-5-10-18-15/h7-8,12,15,18H,4-6,9-11H2,1-3H3
InChIKeyZXSFWPQSFKDVRX-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.61
Rot. Bonds5

About 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide

3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide (PubChem CID 43187175) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide
PubChem CID43187175
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide
SMILESCOc1cc(C(=O)N(C)CCC2CCCCN2)ccc1C
InChIInChI=1S/C17H26N2O2/c1-13-7-8-14(12-16(13)21-3)17(20)19(2)11-9-15-6-4-5-10-18-15/h7-8,12,15,18H,4-6,9-11H2,1-3H3
InChIKeyZXSFWPQSFKDVRX-UHFFFAOYSA-N
XLogP2.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-4-methoxy-N-methyl-N-(2-piperidin-2-ylethyl)benzamide
CID 79737443
3-methoxy-N,4-dimethyl-N-(2-piperidin-4-ylethyl)benzamide
CID 60914907
3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide
CID 43187173
3-methoxy-4-methyl-N-(pyrrolidin-2-ylmethyl)benzamide;hydrochloride
CID 119509893
3-methoxy-N,4-dimethyl-N-(piperidin-4-ylmethyl)benzamide
CID 79721035
2-ethoxy-N-methyl-N-(2-piperidin-2-ylethyl)benzamide
CID 43187149
methyl N-methyl-N-(2-piperidin-2-ylethyl)carbamate
CID 43187204
N-cyclopentyl-N-ethyl-3-methoxy-4-methylbenzamide
CID 134060958
N-(2-aminocyclohexyl)-3-methoxy-N,4-dimethylbenzamide
CID 102638874
N-(5-aminopentyl)-3-methoxy-N,4-dimethylbenzamide
CID 107206573
N-[(3-hydroxypyrrolidin-3-yl)methyl]-3-methoxy-N,4-dimethylbenzamide
CID 114760467
N,2,5-trimethyl-N-(2-piperidin-2-ylethyl)pyrazole-3-carboxamide
CID 66126689

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide?
The IUPAC name of 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide (CID 43187175) is 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide.
What is the SMILES notation for 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide?
The canonical SMILES for 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide is COc1cc(C(=O)N(C)CCC2CCCCN2)ccc1C.
What is the InChIKey of 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide?
The InChIKey is ZXSFWPQSFKDVRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13-7-8-14(12-16(13)21-3)17(20)19(2)11-9-15-6-4-5-10-18-15/h7-8,12,15,18H,4-6,9-11H2,1-3H3.
What are the key properties of 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide?
3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide has a molecular weight of 290.41 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide is sourced from PubChem (CID 43187175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).