N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide

C17H26N2O3 — CID 120621206

IUPACN-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCCOc1cccc(CNC(=O)C2(COC)CCNCC2)c1
InChIInChI=1S/C17H26N2O3/c1-3-22-15-6-4-5-14(11-15)12-19-16(20)17(13-21-2)7-9-18-10-8-17/h4-6,11,18H,3,7-10,12-13H2,1-2H3,(H,19,20)
InChIKeyUXAREAZQMKQBDC-UHFFFAOYSA-N
MW306.41 g/mol
LogP1.72
Rot. Bonds7

About N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide

N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 120621206) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID120621206
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC NameN-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCCOc1cccc(CNC(=O)C2(COC)CCNCC2)c1
InChIInChI=1S/C17H26N2O3/c1-3-22-15-6-4-5-14(11-15)12-19-16(20)17(13-21-2)7-9-18-10-8-17/h4-6,11,18H,3,7-10,12-13H2,1-2H3,(H,19,20)
InChIKeyUXAREAZQMKQBDC-UHFFFAOYSA-N
XLogP1.72
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-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-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide
CID 63128509
N-[[3-[(dimethylamino)methyl]phenyl]methyl]-4-(methoxymethyl)piperidine-4-carboxamide;dihydrochloride
CID 120641219
N-benzyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616012
4-(methoxymethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxamide
CID 120617133
4-(methoxymethyl)-N-[[3-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]piperidine-4-carboxamide;dihydrochloride
CID 120645298
N-[2-(3-chlorophenoxy)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120623811
4-(methoxymethyl)-N-[[4-(methoxymethyl)phenyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 120621722
4-(methoxymethyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide;hydrochloride
CID 120618412
methyl 2-[3-[[(4-methoxypiperidine-4-carbonyl)amino]methyl]phenoxy]acetate
CID 119787129
4-methoxy-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 119678226
N-[3-[[[4-(methoxymethyl)piperidine-4-carbonyl]amino]methyl]phenyl]pyridine-4-carboxamide;dihydrochloride
CID 120645145
N-[[3-[2-(dimethylamino)ethoxy]phenyl]methyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride
CID 119845776

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide (CID 120621206) is N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide is CCOc1cccc(CNC(=O)C2(COC)CCNCC2)c1.
What is the InChIKey of N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is UXAREAZQMKQBDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-3-22-15-6-4-5-14(11-15)12-19-16(20)17(13-21-2)7-9-18-10-8-17/h4-6,11,18H,3,7-10,12-13H2,1-2H3,(H,19,20).
What are the key properties of N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide?
N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 306.41 g/mol, XLogP of 1.72, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethoxyphenyl)methyl]-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 120621206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).