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

C19H34N4O3 — CID 91923422

IUPAC2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCC(C)CNC(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)N(C)C2
InChIInChI=1S/C19H34N4O3/c1-15(2)13-20-18(25)23-6-4-19(5-7-23)12-16(21(3)14-19)17(24)22-8-10-26-11-9-22/h15-16H,4-14H2,1-3H3,(H,20,25)
InChIKeyAVBGAXVFYXCIJG-UHFFFAOYSA-N
MW366.51 g/mol
LogP1.00
Rot. Bonds3

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

2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 91923422) has the molecular formula C19H34N4O3 and a molecular weight of 366.51 g/mol. Its IUPAC name is 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID91923422
Molecular FormulaC19H34N4O3
Molecular Weight366.51 g/mol
Exact Mass366.26
IUPAC Name2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCC(C)CNC(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)N(C)C2
InChIInChI=1S/C19H34N4O3/c1-15(2)13-20-18(25)23-6-4-19(5-7-23)12-16(21(3)14-19)17(24)22-8-10-26-11-9-22/h15-16H,4-14H2,1-3H3,(H,20,25)
InChIKeyAVBGAXVFYXCIJG-UHFFFAOYSA-N
XLogP1.00
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide (CID 91923422) is 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide is CC(C)CNC(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)N(C)C2.
What is the InChIKey of 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is AVBGAXVFYXCIJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O3/c1-15(2)13-20-18(25)23-6-4-19(5-7-23)12-16(21(3)14-19)17(24)22-8-10-26-11-9-22/h15-16H,4-14H2,1-3H3,(H,20,25).
What are the key properties of 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 366.51 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylpropyl)-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 91923422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).