4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

C19H30N2O4 — CID 46140808

IUPAC4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
SMILESCC1CCCC2(C1)OCC(C(=O)NCC1CCCO1)N2C(=O)C1CC1
InChIInChI=1S/C19H30N2O4/c1-13-4-2-8-19(10-13)21(18(23)14-6-7-14)16(12-25-19)17(22)20-11-15-5-3-9-24-15/h13-16H,2-12H2,1H3,(H,20,22)
InChIKeyHZOUTONYLOFTCN-UHFFFAOYSA-N
MW350.46 g/mol
LogP1.83
Rot. Bonds4

About 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide (PubChem CID 46140808) has the molecular formula C19H30N2O4 and a molecular weight of 350.46 g/mol. Its IUPAC name is 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide.

Molecular Properties

Compound Name4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
PubChem CID46140808
Molecular FormulaC19H30N2O4
Molecular Weight350.46 g/mol
Exact Mass350.22
IUPAC Name4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
SMILESCC1CCCC2(C1)OCC(C(=O)NCC1CCCO1)N2C(=O)C1CC1
InChIInChI=1S/C19H30N2O4/c1-13-4-2-8-19(10-13)21(18(23)14-6-7-14)16(12-25-19)17(22)20-11-15-5-3-9-24-15/h13-16H,2-12H2,1H3,(H,20,22)
InChIKeyHZOUTONYLOFTCN-UHFFFAOYSA-N
XLogP1.83
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-methyl-N-(oxolan-2-ylmethyl)-4-propanoyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71956305
4-(cyclopropanecarbonyl)-N-propyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 42669897
7-methyl-4-(3-methylbutanoyl)-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71819783
8-methyl-4-(3-methylbutanoyl)-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71956178
N-Cyclopropyl-8-methyl-4-(3-methylbutanoyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 71956309
4-(cyclopentanecarbonyl)-N-cyclopropyl-7-methyl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 24712548
1-[7-Methyl-3-(pyrrolidine-1-carbonyl)-1-oxa-4-azaspiro[4.5]decan-4-yl]propan-1-one
CID 24712909
N-[1-[2-(aminomethyl)pyrrolidin-1-yl]-3-(cyclohexylmethoxy)-1-oxobutan-2-yl]acetamide
CID 170755642
N-methyl-2-(2-methylpropanoylamino)-3-[[(1S,4R)-7-oxabicyclo[2.2.1]heptan-2-yl]methoxy]butanamide
CID 171593980
N-[1-[2-(aminomethyl)pyrrolidin-1-yl]-3-(cyclohexylmethoxy)-1-oxobutan-2-yl]-2-methylpropanamide
CID 171594047
(3S)-4-(cyclopropanecarbonyl)-8-methyl-N-propan-2-yl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 8064850
(3R)-4-(cyclopropanecarbonyl)-8-methyl-N-propan-2-yl-1-oxa-4-azaspiro[4.5]decane-3-carboxamide
CID 8064851

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The IUPAC name of 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide (CID 46140808) is 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide.
What is the SMILES notation for 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The canonical SMILES for 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide is CC1CCCC2(C1)OCC(C(=O)NCC1CCCO1)N2C(=O)C1CC1.
What is the InChIKey of 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
The InChIKey is HZOUTONYLOFTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O4/c1-13-4-2-8-19(10-13)21(18(23)14-6-7-14)16(12-25-19)17(22)20-11-15-5-3-9-24-15/h13-16H,2-12H2,1H3,(H,20,22).
What are the key properties of 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide?
4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide has a molecular weight of 350.46 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropanecarbonyl)-7-methyl-N-(oxolan-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 46140808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).