3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide

C18H26N2O4 — CID 17191669

IUPAC3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCCC(=O)N2CCC(C)CC2)c1
InChIInChI=1S/C18H26N2O4/c1-13-5-8-20(9-6-13)17(21)4-7-19-18(22)14-10-15(23-2)12-16(11-14)24-3/h10-13H,4-9H2,1-3H3,(H,19,22)
InChIKeyFBVZRWVVANBTFM-UHFFFAOYSA-N
MW334.42 g/mol
LogP2.08
Rot. Bonds6

About 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide

3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide (PubChem CID 17191669) has the molecular formula C18H26N2O4 and a molecular weight of 334.42 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide
PubChem CID17191669
Molecular FormulaC18H26N2O4
Molecular Weight334.42 g/mol
Exact Mass334.19
IUPAC Name3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCCC(=O)N2CCC(C)CC2)c1
InChIInChI=1S/C18H26N2O4/c1-13-5-8-20(9-6-13)17(21)4-7-19-18(22)14-10-15(23-2)12-16(11-14)24-3/h10-13H,4-9H2,1-3H3,(H,19,22)
InChIKeyFBVZRWVVANBTFM-UHFFFAOYSA-N
XLogP2.08
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[3-[4-[[(3,5-dimethoxybenzoyl)amino]methyl]piperidin-1-yl]-3-oxopropyl]carbamate
CID 108919244
N-[2-(azepan-1-yl)-2-oxoethyl]-3,5-dimethoxybenzamide
CID 26500774
N-[4-[(3,5-dimethoxybenzoyl)amino]butyl]-3,5-dimethoxybenzamide
CID 2933573
3-methoxy-N-[2-[[N-methyl-C-(4-methylpiperidin-1-yl)carbonimidoyl]amino]ethyl]benzamide;hydroiodide
CID 111211698
N-[3-(cyclohexylamino)-3-oxopropyl]-3,5-dimethoxybenzamide
CID 17191583
3,5-dimethoxy-N-[1-[4-(4-methylphenoxy)butanoyl]piperidin-4-yl]benzamide
CID 108550599
3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide
CID 46378959
3-methoxy-N-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]benzamide
CID 17226023
tert-butyl N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]carbamate
CID 24689329
4-bromo-N-[3-[4-(3-methoxybenzoyl)piperazin-1-yl]-3-oxopropyl]benzamide
CID 38046364
3-(4-chloro-2,5-dimethoxyanilino)-1-(4-methylpiperidin-1-yl)propan-1-one
CID 109014463
N-[2-[(3,5-dimethoxybenzoyl)amino]ethyl]-3,5-dihydroxybenzamide
CID 108539471

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide (CID 17191669) is 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide is COc1cc(OC)cc(C(=O)NCCC(=O)N2CCC(C)CC2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide?
The InChIKey is FBVZRWVVANBTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O4/c1-13-5-8-20(9-6-13)17(21)4-7-19-18(22)14-10-15(23-2)12-16(11-14)24-3/h10-13H,4-9H2,1-3H3,(H,19,22).
What are the key properties of 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide?
3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide has a molecular weight of 334.42 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]benzamide is sourced from PubChem (CID 17191669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).