N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide

C14H18N2O3 — CID 12641855

IUPACN-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide
SMILESCN(C(=O)c1ccc2c(c1)OCO2)C1CCNCC1
InChIInChI=1S/C14H18N2O3/c1-16(11-4-6-15-7-5-11)14(17)10-2-3-12-13(8-10)19-9-18-12/h2-3,8,11,15H,4-7,9H2,1H3
InChIKeyLRZHOCNFEVMDQY-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.24
Rot. Bonds2

About N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide

N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide (PubChem CID 12641855) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide.

Molecular Properties

Compound NameN-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide
PubChem CID12641855
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide
SMILESCN(C(=O)c1ccc2c(c1)OCO2)C1CCNCC1
InChIInChI=1S/C14H18N2O3/c1-16(11-4-6-15-7-5-11)14(17)10-2-3-12-13(8-10)19-9-18-12/h2-3,8,11,15H,4-7,9H2,1H3
InChIKeyLRZHOCNFEVMDQY-UHFFFAOYSA-N
XLogP1.24
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide 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

N-methyl-N-piperidin-4-yl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide;hydrochloride
CID 119443523
N-[(3aS,6aR)-5-hydroxy-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]-N-methyl-1,3-benzodioxole-5-carboxamide
CID 134706957
N-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-1,3-benzodioxole-5-carboxamide
CID 7259618
N-methyl-1-oxo-N-piperidin-4-yl-3H-2-benzofuran-5-carboxamide
CID 90190064
ethyl 4-[1,3-benzodioxole-5-carbonyl(methyl)amino]piperidine-1-carboxylate
CID 110866788
4-chloro-3-fluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 107990085
4-(1,3-dithiolan-2-yl)-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119442633
N-(azepan-4-yl)-3,4-dihydroxy-N-methylbenzamide
CID 107728861
N,3,5-trimethyl-N-piperidin-4-ylbenzamide
CID 43602069
N-[(3S,4R)-4-hydroxyoxolan-3-yl]-N-methyl-1,3-benzodioxole-5-carboxamide
CID 91771959
N-methyl-N-(piperidin-4-ylmethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 71642366
3,5-dibromo-N-methyl-N-piperidin-4-ylbenzamide
CID 114022754

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide?
The IUPAC name of N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide (CID 12641855) is N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide.
What is the SMILES notation for N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide?
The canonical SMILES for N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide is CN(C(=O)c1ccc2c(c1)OCO2)C1CCNCC1.
What is the InChIKey of N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide?
The InChIKey is LRZHOCNFEVMDQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-16(11-4-6-15-7-5-11)14(17)10-2-3-12-13(8-10)19-9-18-12/h2-3,8,11,15H,4-7,9H2,1H3.
What are the key properties of N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide?
N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-piperidin-4-yl-1,3-benzodioxole-5-carboxamide is sourced from PubChem (CID 12641855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).