6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide

C21H29N3O3 — CID 146071110

IUPAC6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide
SMILESO=C(NCCc1ccccc1)N1CCC(=O)N(CC2CC2)C2(CCOC2)C1
InChIInChI=1S/C21H29N3O3/c25-19-9-12-23(20(26)22-11-8-17-4-2-1-3-5-17)15-21(10-13-27-16-21)24(19)14-18-6-7-18/h1-5,18H,6-16H2,(H,22,26)
InChIKeyGIGSVQZBXPGJRS-UHFFFAOYSA-N
MW371.48 g/mol
LogP2.04
Rot. Bonds5

About 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide

6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide (PubChem CID 146071110) has the molecular formula C21H29N3O3 and a molecular weight of 371.48 g/mol. Its IUPAC name is 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide.

Molecular Properties

Compound Name6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide
PubChem CID146071110
Molecular FormulaC21H29N3O3
Molecular Weight371.48 g/mol
Exact Mass371.22
IUPAC Name6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide
SMILESO=C(NCCc1ccccc1)N1CCC(=O)N(CC2CC2)C2(CCOC2)C1
InChIInChI=1S/C21H29N3O3/c25-19-9-12-23(20(26)22-11-8-17-4-2-1-3-5-17)15-21(10-13-27-16-21)24(19)14-18-6-7-18/h1-5,18H,6-16H2,(H,22,26)
InChIKeyGIGSVQZBXPGJRS-UHFFFAOYSA-N
XLogP2.04
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide with MolForge

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Related Compounds

6-benzyl-7-oxo-N-propyl-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide
CID 146070649
N-cyclohexyl-6-(cyclopropylmethyl)-7-oxo-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide
CID 146072359
N-(2-chloro-4-methylphenyl)-6-(cyclopropylmethyl)-7-oxo-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide
CID 146071150
6-[(4-fluorophenyl)methyl]-10-(3-phenylpropanoyl)-2-oxa-6,10-diazaspiro[4.6]undecan-7-one
CID 146066809
6-benzyl-10-(thiophene-2-carbonyl)-2-oxa-6,10-diazaspiro[4.6]undecan-7-one
CID 146068336
6-benzyl-10-(5-chloro-2-fluorobenzoyl)-2-oxa-6,10-diazaspiro[4.6]undecan-7-one
CID 146068341
N-benzyl-1-(cyclopropylmethyl)-2-oxo-1,9-diazaspiro[4.6]undecane-9-carboxamide
CID 131661655
6-benzyl-10-[2-(4-methylpyrazol-1-yl)acetyl]-2-oxa-6,10-diazaspiro[4.6]undecan-7-one
CID 146070657
4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]methyl]-N-(2-phenylethyl)piperidine-1-carboxamide
CID 92731410
6-benzyl-10-ethylsulfonyl-2-oxa-6,10-diazaspiro[4.6]undecan-7-one
CID 146068335
10-(2-ethoxybenzoyl)-6-[(4-fluorophenyl)methyl]-2-oxa-6,10-diazaspiro[4.6]undecan-7-one
CID 146066856
1-benzyl-3-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]urea
CID 97494267

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide?
The IUPAC name of 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide (CID 146071110) is 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide.
What is the SMILES notation for 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide?
The canonical SMILES for 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide is O=C(NCCc1ccccc1)N1CCC(=O)N(CC2CC2)C2(CCOC2)C1.
What is the InChIKey of 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide?
The InChIKey is GIGSVQZBXPGJRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O3/c25-19-9-12-23(20(26)22-11-8-17-4-2-1-3-5-17)15-21(10-13-27-16-21)24(19)14-18-6-7-18/h1-5,18H,6-16H2,(H,22,26).
What are the key properties of 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide?
6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide has a molecular weight of 371.48 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethyl)-7-oxo-N-(2-phenylethyl)-2-oxa-6,10-diazaspiro[4.6]undecane-10-carboxamide is sourced from PubChem (CID 146071110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).