3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide

C17H26N2O3 — CID 119443778

IUPAC3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide
SMILESCOc1cc(C(=O)N(C)C2CCNCC2)ccc1OC(C)C
InChIInChI=1S/C17H26N2O3/c1-12(2)22-15-6-5-13(11-16(15)21-4)17(20)19(3)14-7-9-18-10-8-14/h5-6,11-12,14,18H,7-10H2,1-4H3
InChIKeyTTXWKWWBNXJVBK-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.31
Rot. Bonds5

About 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide

3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide (PubChem CID 119443778) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide.

Molecular Properties

Compound Name3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide
PubChem CID119443778
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide
SMILESCOc1cc(C(=O)N(C)C2CCNCC2)ccc1OC(C)C
InChIInChI=1S/C17H26N2O3/c1-12(2)22-15-6-5-13(11-16(15)21-4)17(20)19(3)14-7-9-18-10-8-14/h5-6,11-12,14,18H,7-10H2,1-4H3
InChIKeyTTXWKWWBNXJVBK-UHFFFAOYSA-N
XLogP2.31
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methoxy-N-methyl-4-(3-methylbutoxy)-N-piperidin-4-ylbenzamide;hydrochloride
CID 119443779
3-methoxy-N-methyl-4-[2-oxo-2-(propan-2-ylamino)ethoxy]-N-piperidin-4-ylbenzamide;hydrochloride
CID 119443929
3-methoxy-4-propan-2-yloxy-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119532395
N-(azepan-4-yl)-4-fluoro-3-methoxy-N-methylbenzamide
CID 107172564
N-methyl-N-piperidin-4-yl-3,4-dipropoxybenzamide
CID 119443973
3-methoxy-N-methyl-N-piperidin-4-yl-4-(1,3-thiazol-4-ylmethoxy)benzamide;dihydrochloride
CID 119444457
4-cyclopentyloxy-3-methoxy-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119552147
3,4-dimethoxy-N-methyl-N-(4-oxocyclohexyl)benzamide
CID 79118265
2,6-dimethoxy-N-methyl-N-piperidin-4-ylbenzamide
CID 43602191
4-(2-amino-2-oxoethoxy)-N-cyclopropyl-3-methoxy-N-methylbenzamide
CID 47414265
1-[(3-methoxy-4-propan-2-yloxybenzoyl)-methylamino]cyclohexane-1-carboxylic acid
CID 120539762
(3-methoxy-4-propan-2-yloxyphenyl)-pyrrolidin-2-ylmethanone
CID 82552949

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide?
The IUPAC name of 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide (CID 119443778) is 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide.
What is the SMILES notation for 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide?
The canonical SMILES for 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide is COc1cc(C(=O)N(C)C2CCNCC2)ccc1OC(C)C.
What is the InChIKey of 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide?
The InChIKey is TTXWKWWBNXJVBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-12(2)22-15-6-5-13(11-16(15)21-4)17(20)19(3)14-7-9-18-10-8-14/h5-6,11-12,14,18H,7-10H2,1-4H3.
What are the key properties of 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide?
3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide has a molecular weight of 306.41 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-methyl-N-piperidin-4-yl-4-propan-2-yloxybenzamide is sourced from PubChem (CID 119443778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).