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

C18H32N4O3 — CID 91923419

IUPAC2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCCCNC(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)N(C)C2
InChIInChI=1S/C18H32N4O3/c1-3-6-19-17(24)22-7-4-18(5-8-22)13-15(20(2)14-18)16(23)21-9-11-25-12-10-21/h15H,3-14H2,1-2H3,(H,19,24)
InChIKeyWPBSVQIOZITWRV-UHFFFAOYSA-N
MW352.48 g/mol
LogP0.75
Rot. Bonds3

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

2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 91923419) has the molecular formula C18H32N4O3 and a molecular weight of 352.48 g/mol. Its IUPAC name is 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound Name2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID91923419
Molecular FormulaC18H32N4O3
Molecular Weight352.48 g/mol
Exact Mass352.25
IUPAC Name2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCCCNC(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)N(C)C2
InChIInChI=1S/C18H32N4O3/c1-3-6-19-17(24)22-7-4-18(5-8-22)13-15(20(2)14-18)16(23)21-9-11-25-12-10-21/h15H,3-14H2,1-2H3,(H,19,24)
InChIKeyWPBSVQIOZITWRV-UHFFFAOYSA-N
XLogP0.75
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide (CID 91923419) is 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide is CCCNC(=O)N1CCC2(CC1)CC(C(=O)N1CCOCC1)N(C)C2.
What is the InChIKey of 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is WPBSVQIOZITWRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O3/c1-3-6-19-17(24)22-7-4-18(5-8-22)13-15(20(2)14-18)16(23)21-9-11-25-12-10-21/h15H,3-14H2,1-2H3,(H,19,24).
What are the key properties of 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide?
2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 352.48 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(morpholine-4-carbonyl)-N-propyl-2,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 91923419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).