2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide

C19H24N2O3 — CID 20926300

IUPAC2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide
SMILESCC1CCN(C(=O)c2oc3ccccc3c2NC(=O)C(C)C)CC1
InChIInChI=1S/C19H24N2O3/c1-12(2)18(22)20-16-14-6-4-5-7-15(14)24-17(16)19(23)21-10-8-13(3)9-11-21/h4-7,12-13H,8-11H2,1-3H3,(H,20,22)
InChIKeyWBSYXXHSWBDTIQ-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.90
Rot. Bonds3

About 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide

2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide (PubChem CID 20926300) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide
PubChem CID20926300
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide
SMILESCC1CCN(C(=O)c2oc3ccccc3c2NC(=O)C(C)C)CC1
InChIInChI=1S/C19H24N2O3/c1-12(2)18(22)20-16-14-6-4-5-7-15(14)24-17(16)19(23)21-10-8-13(3)9-11-21/h4-7,12-13H,8-11H2,1-3H3,(H,20,22)
InChIKeyWBSYXXHSWBDTIQ-UHFFFAOYSA-N
XLogP3.90
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylphenyl)-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]acetamide
CID 22511152
3-fluoro-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]benzamide
CID 20926283
(2S)-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-phenoxypropanamide
CID 51457035
[1-(3-methyl-1-benzofuran-2-carbonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone
CID 47067179
5-(4-methoxyphenyl)-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]-1,2-oxazole-3-carboxamide
CID 46271206
2-(4-methylpiperidine-1-carbonyl)chromen-4-one
CID 26773752
N-(2-acetyl-1-benzofuran-3-yl)-2-[(3R)-3-hydroxypyrrolidin-1-yl]propanamide
CID 111334114
N-[2-(4-chlorobenzoyl)-1-benzofuran-3-yl]-2-methylpropanamide
CID 4067766
(2S)-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]oxolane-2-carboxamide
CID 95339435
3-cyclopropyl-N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]propanamide
CID 71931115
2-methoxy-N-[2-(4-piperidin-1-ylpiperidine-1-carbonyl)-1-benzofuran-3-yl]benzamide
CID 20925967
N-[2-(4-propylpiperazine-1-carbonyl)-1-benzofuran-3-yl]cyclopentanecarboxamide
CID 20925750

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide?
The IUPAC name of 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide (CID 20926300) is 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide.
What is the SMILES notation for 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide?
The canonical SMILES for 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide is CC1CCN(C(=O)c2oc3ccccc3c2NC(=O)C(C)C)CC1.
What is the InChIKey of 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide?
The InChIKey is WBSYXXHSWBDTIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-12(2)18(22)20-16-14-6-4-5-7-15(14)24-17(16)19(23)21-10-8-13(3)9-11-21/h4-7,12-13H,8-11H2,1-3H3,(H,20,22).
What are the key properties of 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide?
2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide has a molecular weight of 328.41 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(4-methylpiperidine-1-carbonyl)-1-benzofuran-3-yl]propanamide is sourced from PubChem (CID 20926300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).