N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide

C21H36N4O3 — CID 91911310

IUPACN-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCN1CC2(CCN(C(=O)NC3CCCCC3)CC2)CC1C(=O)N1CCOCC1
InChIInChI=1S/C21H36N4O3/c1-23-16-21(15-18(23)19(26)24-11-13-28-14-12-24)7-9-25(10-8-21)20(27)22-17-5-3-2-4-6-17/h17-18H,2-16H2,1H3,(H,22,27)
InChIKeyXHCVPBKWSVLVRM-UHFFFAOYSA-N
MW392.54 g/mol
LogP1.67
Rot. Bonds2

About N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide

N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 91911310) has the molecular formula C21H36N4O3 and a molecular weight of 392.54 g/mol. Its IUPAC name is N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID91911310
Molecular FormulaC21H36N4O3
Molecular Weight392.54 g/mol
Exact Mass392.28
IUPAC NameN-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCN1CC2(CCN(C(=O)NC3CCCCC3)CC2)CC1C(=O)N1CCOCC1
InChIInChI=1S/C21H36N4O3/c1-23-16-21(15-18(23)19(26)24-11-13-28-14-12-24)7-9-25(10-8-21)20(27)22-17-5-3-2-4-6-17/h17-18H,2-16H2,1H3,(H,22,27)
InChIKeyXHCVPBKWSVLVRM-UHFFFAOYSA-N
XLogP1.67
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.54
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide (CID 91911310) is N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide is CN1CC2(CCN(C(=O)NC3CCCCC3)CC2)CC1C(=O)N1CCOCC1.
What is the InChIKey of N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is XHCVPBKWSVLVRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H36N4O3/c1-23-16-21(15-18(23)19(26)24-11-13-28-14-12-24)7-9-25(10-8-21)20(27)22-17-5-3-2-4-6-17/h17-18H,2-16H2,1H3,(H,22,27).
What are the key properties of N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 392.54 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 91911310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).