4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide

C19H29N3O2 — CID 91922025

IUPAC4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide
SMILESCOCC1CN(C(=O)NCCc2ccccc2)CC12CCNCC2
InChIInChI=1S/C19H29N3O2/c1-24-14-17-13-22(15-19(17)8-11-20-12-9-19)18(23)21-10-7-16-5-3-2-4-6-16/h2-6,17,20H,7-15H2,1H3,(H,21,23)
InChIKeyBVASNMYFAHLINC-UHFFFAOYSA-N
MW331.46 g/mol
LogP1.89
Rot. Bonds5

About 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide

4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide (PubChem CID 91922025) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide.

Molecular Properties

Compound Name4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide
PubChem CID91922025
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC Name4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide
SMILESCOCC1CN(C(=O)NCCc2ccccc2)CC12CCNCC2
InChIInChI=1S/C19H29N3O2/c1-24-14-17-13-22(15-19(17)8-11-20-12-9-19)18(23)21-10-7-16-5-3-2-4-6-16/h2-6,17,20H,7-15H2,1H3,(H,21,23)
InChIKeyBVASNMYFAHLINC-UHFFFAOYSA-N
XLogP1.89
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-(2-phenylethyl)piperidine-4-carboxamide;hydrochloride
CID 119670076
1-[(5R,9S)-9-(methoxymethyl)-7-methyl-2,7-diazaspiro[4.4]nonan-2-yl]-2-phenylethanone
CID 97484939
[4-(methoxymethyl)-8-oxa-2-azaspiro[4.5]decan-2-yl]-(1-phenylcyclopropyl)methanone
CID 91915827
[4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-(4-methyl-1,3-oxazol-5-yl)methanone
CID 91921993
2-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2,3-dicarboxamide
CID 67104250
[4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-2-yl]-(4-methyl-1,3-oxazol-5-yl)methanone;hydrochloride
CID 146074245
4-methyl-1-(2-phenylethylcarbamoyl)pyrrolidine-3-carboxylic acid
CID 63721294
2-[1-(2-phenylethylcarbamoyl)azetidin-3-yl]propanoic acid
CID 116682805
2-[3-methyl-1-(2-phenylethylcarbamoyl)azetidin-3-yl]oxyacetic acid
CID 102658501
1-[2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-phenylethanone
CID 91922207
(3aR,6aS)-5-ethyl-6-oxo-2-(2-phenylethylcarbamoyl)-1,3,4,6a-tetrahydropyrrolo[3,4-c]pyrrole-3a-carboxylic acid
CID 56891921
5-methyl-1-(2-phenylethylcarbamoyl)piperidine-3-carboxylic acid
CID 122121841

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide?
The IUPAC name of 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide (CID 91922025) is 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide.
What is the SMILES notation for 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide?
The canonical SMILES for 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide is COCC1CN(C(=O)NCCc2ccccc2)CC12CCNCC2.
What is the InChIKey of 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide?
The InChIKey is BVASNMYFAHLINC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-24-14-17-13-22(15-19(17)8-11-20-12-9-19)18(23)21-10-7-16-5-3-2-4-6-16/h2-6,17,20H,7-15H2,1H3,(H,21,23).
What are the key properties of 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide?
4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide has a molecular weight of 331.46 g/mol, XLogP of 1.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-2-carboxamide is sourced from PubChem (CID 91922025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).