4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide

C21H41N3O3 — CID 67023553

IUPAC4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide
SMILESCC(C)(C)OCC(CN1CCOCC1)NC(=O)CCC(N)C1CCCCC1
InChIInChI=1S/C21H41N3O3/c1-21(2,3)27-16-18(15-24-11-13-26-14-12-24)23-20(25)10-9-19(22)17-7-5-4-6-8-17/h17-19H,4-16,22H2,1-3H3,(H,23,25)
InChIKeyWEBQFGYYLYTXIM-UHFFFAOYSA-N
MW383.58 g/mol
LogP2.31
Rot. Bonds9

About 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide

4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide (PubChem CID 67023553) has the molecular formula C21H41N3O3 and a molecular weight of 383.58 g/mol. Its IUPAC name is 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide.

Molecular Properties

Compound Name4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide
PubChem CID67023553
Molecular FormulaC21H41N3O3
Molecular Weight383.58 g/mol
Exact Mass383.31
IUPAC Name4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide
SMILESCC(C)(C)OCC(CN1CCOCC1)NC(=O)CCC(N)C1CCCCC1
InChIInChI=1S/C21H41N3O3/c1-21(2,3)27-16-18(15-24-11-13-26-14-12-24)23-20(25)10-9-19(22)17-7-5-4-6-8-17/h17-19H,4-16,22H2,1-3H3,(H,23,25)
InChIKeyWEBQFGYYLYTXIM-UHFFFAOYSA-N
XLogP2.31
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.58
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide 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-(2-morpholinoethyl)-4-pentylcyclohexanecarboxamide
CID 3731631
4-methyl-N-(3-methyl-1-{[3-(morpholin-4-yl)propyl]amino}-1-oxobutan-2-yl)cyclohexanecarboxamide
CID 3243058
3-cyclohexyl-N-(2-morpholin-4-ylethyl)propanamide
CID 1537522
4-ethyl-N-(3-methyl-1-{[2-(morpholin-4-yl)ethyl]amino}-1-oxobutan-2-yl)cyclohexanecarboxamide
CID 3390135
N~2~-[(4-methylcyclohexyl)carbonyl]-N-[2-(morpholin-4-yl)ethyl]leucinamide
CID 16478659
N-[2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-oxoethyl]cyclohexanecarboxamide
CID 25163204
1-acetamido-N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclohexane-1-carboxamide
CID 71880006
(2S,4R)-N-(2-morpholin-4-ylethyl)-4-undecylpiperidine-2-carboxamide
CID 155555474
(2S,4R)-4-cyclohexyl-N-(2-morpholin-4-ylethyl)piperidine-2-carboxamide
CID 156018388
(2S,4R)-4-(2-cyclohexylethyl)-N-(2-morpholin-4-ylethyl)piperidine-2-carboxamide
CID 156019194
(2S,4R)-4-(2-cyclohexylethyl)-N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide
CID 156020179
(2R)-2-cyclohexyl-2-[(2S)-2-[4-(2-methoxyethyl)piperazine-1-carbonyl]pyrrolidin-1-yl]-N-methylacetamide
CID 75411411

Frequently Asked Questions

What is the IUPAC name of 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide?
The IUPAC name of 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide (CID 67023553) is 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide.
What is the SMILES notation for 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide?
The canonical SMILES for 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide is CC(C)(C)OCC(CN1CCOCC1)NC(=O)CCC(N)C1CCCCC1.
What is the InChIKey of 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide?
The InChIKey is WEBQFGYYLYTXIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H41N3O3/c1-21(2,3)27-16-18(15-24-11-13-26-14-12-24)23-20(25)10-9-19(22)17-7-5-4-6-8-17/h17-19H,4-16,22H2,1-3H3,(H,23,25).
What are the key properties of 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide?
4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide has a molecular weight of 383.58 g/mol, XLogP of 2.31, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-4-cyclohexyl-N-[1-[(2-methylpropan-2-yl)oxy]-3-morpholin-4-ylpropan-2-yl]butanamide is sourced from PubChem (CID 67023553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).