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

C19H34N4O3 — CID 91923416

IUPACN-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCN1CC2(CCN(C(=O)NC(C)(C)C)CC2)CC1C(=O)N1CCOCC1
InChIInChI=1S/C19H34N4O3/c1-18(2,3)20-17(25)23-7-5-19(6-8-23)13-15(21(4)14-19)16(24)22-9-11-26-12-10-22/h15H,5-14H2,1-4H3,(H,20,25)
InChIKeyMCUKRBPSKPPIIG-UHFFFAOYSA-N
MW366.51 g/mol
LogP1.14
Rot. Bonds1

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

N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 91923416) has the molecular formula C19H34N4O3 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID91923416
Molecular FormulaC19H34N4O3
Molecular Weight366.51 g/mol
Exact Mass366.26
IUPAC NameN-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCN1CC2(CCN(C(=O)NC(C)(C)C)CC2)CC1C(=O)N1CCOCC1
InChIInChI=1S/C19H34N4O3/c1-18(2,3)20-17(25)23-7-5-19(6-8-23)13-15(21(4)14-19)16(24)22-9-11-26-12-10-22/h15H,5-14H2,1-4H3,(H,20,25)
InChIKeyMCUKRBPSKPPIIG-UHFFFAOYSA-N
XLogP1.14
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide (CID 91923416) is N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide is CN1CC2(CCN(C(=O)NC(C)(C)C)CC2)CC1C(=O)N1CCOCC1.
What is the InChIKey of N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is MCUKRBPSKPPIIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O3/c1-18(2,3)20-17(25)23-7-5-19(6-8-23)13-15(21(4)14-19)16(24)22-9-11-26-12-10-22/h15H,5-14H2,1-4H3,(H,20,25).
What are the key properties of N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide?
N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 366.51 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 91923416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).