N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide

C18H25N3O3 — CID 97397451

IUPACN-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide
SMILESCc1oncc1C(=O)NC1CCC2(CCC(=O)N2CC2CC2)CC1
InChIInChI=1S/C18H25N3O3/c1-12-15(10-19-24-12)17(23)20-14-4-7-18(8-5-14)9-6-16(22)21(18)11-13-2-3-13/h10,13-14H,2-9,11H2,1H3,(H,20,23)
InChIKeyLXYIOWIBKAIYMU-UHFFFAOYSA-N
MW331.42 g/mol
LogP2.43
Rot. Bonds4

About N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide

N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide (PubChem CID 97397451) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide
PubChem CID97397451
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC NameN-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide
SMILESCc1oncc1C(=O)NC1CCC2(CCC(=O)N2CC2CC2)CC1
InChIInChI=1S/C18H25N3O3/c1-12-15(10-19-24-12)17(23)20-14-4-7-18(8-5-14)9-6-16(22)21(18)11-13-2-3-13/h10,13-14H,2-9,11H2,1H3,(H,20,23)
InChIKeyLXYIOWIBKAIYMU-UHFFFAOYSA-N
XLogP2.43
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide (CID 97397451) is N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide is Cc1oncc1C(=O)NC1CCC2(CCC(=O)N2CC2CC2)CC1.
What is the InChIKey of N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide?
The InChIKey is LXYIOWIBKAIYMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-12-15(10-19-24-12)17(23)20-14-4-7-18(8-5-14)9-6-16(22)21(18)11-13-2-3-13/h10,13-14H,2-9,11H2,1H3,(H,20,23).
What are the key properties of N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide?
N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 97397451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).