N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide

C17H26N2O2 — CID 106629432

IUPACN-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCCN(CC1CCCNC1)C(=O)c1cc(C)ccc1OC
InChIInChI=1S/C17H26N2O2/c1-4-19(12-14-6-5-9-18-11-14)17(20)15-10-13(2)7-8-16(15)21-3/h7-8,10,14,18H,4-6,9,11-12H2,1-3H3
InChIKeyIOXPHGUJSSHHQC-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.47
Rot. Bonds5

About N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide

N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 106629432) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound NameN-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide
PubChem CID106629432
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCCN(CC1CCCNC1)C(=O)c1cc(C)ccc1OC
InChIInChI=1S/C17H26N2O2/c1-4-19(12-14-6-5-9-18-11-14)17(20)15-10-13(2)7-8-16(15)21-3/h7-8,10,14,18H,4-6,9,11-12H2,1-3H3
InChIKeyIOXPHGUJSSHHQC-UHFFFAOYSA-N
XLogP2.47
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 ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627649
N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-1-piperidin-3-ylmethanamine
CID 103815655
N-[(2-methoxy-5-methylphenyl)methyl]-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106637432
N-ethyl-2-(4-methoxyphenyl)-N-(piperidin-3-ylmethyl)acetamide
CID 106629299
N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide
CID 106629522
3-chloro-N-ethyl-2-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 107098424
N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)furan-3-carboxamide
CID 106629294
N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide
CID 66181476
4-chloro-N-ethyl-3-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106629289
2-fluoro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106628063
N-(2-methoxy-5-methylphenyl)-2-piperidin-3-ylacetamide
CID 62689682
5-chloro-N-ethyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609149

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide (CID 106629432) is N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide is CCN(CC1CCCNC1)C(=O)c1cc(C)ccc1OC.
What is the InChIKey of N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is IOXPHGUJSSHHQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-19(12-14-6-5-9-18-11-14)17(20)15-10-13(2)7-8-16(15)21-3/h7-8,10,14,18H,4-6,9,11-12H2,1-3H3.
What are the key properties of N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide?
N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 290.41 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 106629432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).