N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide

C17H26N2O2 — CID 63128509

IUPACN-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide
SMILESCCOc1cccc(CNC(=O)C2(CC)CCNCC2)c1
InChIInChI=1S/C17H26N2O2/c1-3-17(8-10-18-11-9-17)16(20)19-13-14-6-5-7-15(12-14)21-4-2/h5-7,12,18H,3-4,8-11,13H2,1-2H3,(H,19,20)
InChIKeyKKBVOXUTSPOFIQ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.48
Rot. Bonds6

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

N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide (PubChem CID 63128509) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide
PubChem CID63128509
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide
SMILESCCOc1cccc(CNC(=O)C2(CC)CCNCC2)c1
InChIInChI=1S/C17H26N2O2/c1-3-17(8-10-18-11-9-17)16(20)19-13-14-6-5-7-15(12-14)21-4-2/h5-7,12,18H,3-4,8-11,13H2,1-2H3,(H,19,20)
InChIKeyKKBVOXUTSPOFIQ-UHFFFAOYSA-N
XLogP2.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-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-(methoxymethyl)piperidine-4-carboxamide
CID 120621206
4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide
CID 63127725
methyl 2-[3-[[(4-methoxypiperidine-4-carbonyl)amino]methyl]phenoxy]acetate
CID 119787129
3-ethyl-N-[(3-fluorophenyl)methyl]pyrrolidine-3-carboxamide
CID 55165134
4-methoxy-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 119678226
3-ethyl-N-[[3-(hydroxymethyl)phenyl]methyl]piperidine-3-carboxamide
CID 107218375
N-[(3-methylphenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63128555
4-[[(4-ethylpiperidine-4-carbonyl)amino]methyl]benzoic acid
CID 63128895
N-[(3-chlorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127551
N-[(3-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127726
N-(4-ethoxy-2-methylphenyl)-4-ethylpiperidine-4-carboxamide
CID 63128389
1-[(3-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)urea
CID 110894196

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide?
The IUPAC name of N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide (CID 63128509) is N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide?
The canonical SMILES for N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide is CCOc1cccc(CNC(=O)C2(CC)CCNCC2)c1.
What is the InChIKey of N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide?
The InChIKey is KKBVOXUTSPOFIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-17(8-10-18-11-9-17)16(20)19-13-14-6-5-7-15(12-14)21-4-2/h5-7,12,18H,3-4,8-11,13H2,1-2H3,(H,19,20).
What are the key properties of N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide?
N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide is sourced from PubChem (CID 63128509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).