N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide

C18H26N2O4 — CID 110820607

IUPACN-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide
SMILESCCCC(=O)NC1CCN(C(=O)c2c(OC)cccc2OC)CC1
InChIInChI=1S/C18H26N2O4/c1-4-6-16(21)19-13-9-11-20(12-10-13)18(22)17-14(23-2)7-5-8-15(17)24-3/h5,7-8,13H,4,6,9-12H2,1-3H3,(H,19,21)
InChIKeyLOUXWIKEXRZGRY-UHFFFAOYSA-N
MW334.42 g/mol
LogP2.22
Rot. Bonds6

About N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide

N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide (PubChem CID 110820607) has the molecular formula C18H26N2O4 and a molecular weight of 334.42 g/mol. Its IUPAC name is N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide.

Molecular Properties

Compound NameN-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide
PubChem CID110820607
Molecular FormulaC18H26N2O4
Molecular Weight334.42 g/mol
Exact Mass334.19
IUPAC NameN-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide
SMILESCCCC(=O)NC1CCN(C(=O)c2c(OC)cccc2OC)CC1
InChIInChI=1S/C18H26N2O4/c1-4-6-16(21)19-13-9-11-20(12-10-13)18(22)17-14(23-2)7-5-8-15(17)24-3/h5,7-8,13H,4,6,9-12H2,1-3H3,(H,19,21)
InChIKeyLOUXWIKEXRZGRY-UHFFFAOYSA-N
XLogP2.22
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 ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]acetamide
CID 108563833
3-cyclohexyl-N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]propanamide
CID 108555663
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-2,6-dimethoxybenzamide
CID 108549752
N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]butanamide
CID 52605797
2-chloroethyl N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]carbamate
CID 108563826
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-2-(2,3-dimethylphenoxy)acetamide
CID 108552797
N-[2-[[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]amino]-2-oxoethyl]benzamide
CID 108550402
N-[1-(6-fluoropyridine-2-carbonyl)piperidin-4-yl]butanamide
CID 115497488
N-cyclopentyl-4-(2,6-dimethoxybenzoyl)piperazine-1-carboxamide
CID 110810749
2-chloro-N-[1-(2-methoxybenzoyl)piperidin-4-yl]acetamide
CID 108563596
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-3-fluorobenzamide
CID 108557453
tert-butyl N-[1-(2-bromo-6-methoxybenzoyl)piperidin-4-yl]carbamate
CID 171934603

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide?
The IUPAC name of N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide (CID 110820607) is N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide.
What is the SMILES notation for N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide?
The canonical SMILES for N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide is CCCC(=O)NC1CCN(C(=O)c2c(OC)cccc2OC)CC1.
What is the InChIKey of N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide?
The InChIKey is LOUXWIKEXRZGRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O4/c1-4-6-16(21)19-13-9-11-20(12-10-13)18(22)17-14(23-2)7-5-8-15(17)24-3/h5,7-8,13H,4,6,9-12H2,1-3H3,(H,19,21).
What are the key properties of N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide?
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide has a molecular weight of 334.42 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]butanamide is sourced from PubChem (CID 110820607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).