N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide

C19H28N2O3 — CID 159510445

IUPACN-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide
SMILESCCC(=O)NCC1CCCCC1CNC(=O)COc1ccccc1
InChIInChI=1S/C19H28N2O3/c1-2-18(22)20-12-15-8-6-7-9-16(15)13-21-19(23)14-24-17-10-4-3-5-11-17/h3-5,10-11,15-16H,2,6-9,12-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyMANMJCVTGNMNDG-UHFFFAOYSA-N
MW332.44 g/mol
LogP2.51
Rot. Bonds8

About N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide

N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide (PubChem CID 159510445) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide.

Molecular Properties

Compound NameN-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide
PubChem CID159510445
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide
SMILESCCC(=O)NCC1CCCCC1CNC(=O)COc1ccccc1
InChIInChI=1S/C19H28N2O3/c1-2-18(22)20-12-15-8-6-7-9-16(15)13-21-19(23)14-24-17-10-4-3-5-11-17/h3-5,10-11,15-16H,2,6-9,12-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyMANMJCVTGNMNDG-UHFFFAOYSA-N
XLogP2.51
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide 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-cyclooctyl-2-[(2-phenoxyacetyl)amino]acetamide
CID 24635122
N'-(2-phenoxyacetyl)propanehydrazide
CID 4508940
2-(4-bromophenoxy)-N-[(2-hydroxycyclohexyl)methyl]acetamide
CID 64913623
N-[[(2R)-oxiran-2-yl]methyl]-2-phenoxyacetamide
CID 97180854
N-(cyclohexylmethyl)-2-(4-propanoylphenoxy)acetamide
CID 78760578
2-phenoxy-N-[[(15R)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl]methyl]acetamide
CID 30394821
2-phenoxy-N-(piperidin-3-ylmethyl)acetamide
CID 60725547
N-[(3-bromocyclohexyl)methyl]-2-phenoxyacetamide
CID 114147724
2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide
CID 16895414
N-(1-cyclopropylethyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 47117041
2-phenoxy-N-propan-2-ylacetamide
CID 3614481
2-(4-benzoylphenoxy)-N-(cyclopropylmethyl)acetamide
CID 134038104

Frequently Asked Questions

What is the IUPAC name of N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide?
The IUPAC name of N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide (CID 159510445) is N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide.
What is the SMILES notation for N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide?
The canonical SMILES for N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide is CCC(=O)NCC1CCCCC1CNC(=O)COc1ccccc1.
What is the InChIKey of N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide?
The InChIKey is MANMJCVTGNMNDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-2-18(22)20-12-15-8-6-7-9-16(15)13-21-19(23)14-24-17-10-4-3-5-11-17/h3-5,10-11,15-16H,2,6-9,12-14H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide?
N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide has a molecular weight of 332.44 g/mol, XLogP of 2.51, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[[(2-phenoxyacetyl)amino]methyl]cyclohexyl]methyl]propanamide is sourced from PubChem (CID 159510445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).