(5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide

C17H29N3O2 — CID 164633869

IUPAC(5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide
SMILESCC(C)(CNC(=O)N1CCC[C@]2(CNC(=O)C2)C1)C1CCC1
InChIInChI=1S/C17H29N3O2/c1-16(2,13-5-3-6-13)10-19-15(22)20-8-4-7-17(12-20)9-14(21)18-11-17/h13H,3-12H2,1-2H3,(H,18,21)(H,19,22)/t17-/m0/s1
InChIKeyVWRLEGRNFDQMKE-KRWDZBQOSA-N
MW307.44 g/mol
LogP2.12
Rot. Bonds3

About (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide

(5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide (PubChem CID 164633869) has the molecular formula C17H29N3O2 and a molecular weight of 307.44 g/mol. Its IUPAC name is (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide.

Molecular Properties

Compound Name(5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide
PubChem CID164633869
Molecular FormulaC17H29N3O2
Molecular Weight307.44 g/mol
Exact Mass307.23
IUPAC Name(5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide
SMILESCC(C)(CNC(=O)N1CCC[C@]2(CNC(=O)C2)C1)C1CCC1
InChIInChI=1S/C17H29N3O2/c1-16(2,13-5-3-6-13)10-19-15(22)20-8-4-7-17(12-20)9-14(21)18-11-17/h13H,3-12H2,1-2H3,(H,18,21)(H,19,22)/t17-/m0/s1
InChIKeyVWRLEGRNFDQMKE-KRWDZBQOSA-N
XLogP2.12
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.5^{6}.3^{5}]tetradecane-13-carboxamide
CID 118742205
13-(cyclopropylmethyl)-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide
CID 118742280
4-[1-(cyclopentylcarbonyl)tetrahydro-1H-pyrrol-3-yl]-N-methyltetrahydro-1(2H)-pyridinecarboxamide
CID 91910216
N-Methyl-4-[1-(1-methylcyclohexanecarbonyl)pyrrolidin-3-YL]piperidine-1-carboxamide
CID 91921356
(5S)-7-(cyclohexylmethyl)-6-oxo-N-propyl-2,7-diazaspiro[4.5]decane-2-carboxamide
CID 42298022
(5S)-N-tert-butyl-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide
CID 97125831
3-[2-[(5S)-7-(cyclobutylmethyl)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-oxoethyl]-1,1-dimethylurea
CID 97131929
2-Methyl-2,7-diazaspiro[4.5]decan-3-one
CID 84653133
3-[[6-(1-Fluorocyclobutanecarbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]-1,1-dimethylurea
CID 131684927
N-[3-[cyclobutanecarbonyl(methyl)amino]propyl]-2-azaspiro[4.4]nonane-2-carboxamide
CID 71869826
14-ethyl-N,N-dimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide
CID 155901039
5-(4-Ethylpyrrolidin-3-yl)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
CID 12010771

Frequently Asked Questions

What is the IUPAC name of (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide?
The IUPAC name of (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide (CID 164633869) is (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide.
What is the SMILES notation for (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide?
The canonical SMILES for (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide is CC(C)(CNC(=O)N1CCC[C@]2(CNC(=O)C2)C1)C1CCC1.
What is the InChIKey of (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide?
The InChIKey is VWRLEGRNFDQMKE-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H29N3O2/c1-16(2,13-5-3-6-13)10-19-15(22)20-8-4-7-17(12-20)9-14(21)18-11-17/h13H,3-12H2,1-2H3,(H,18,21)(H,19,22)/t17-/m0/s1.
What are the key properties of (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide?
(5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide has a molecular weight of 307.44 g/mol, XLogP of 2.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-N-(2-cyclobutyl-2-methylpropyl)-3-oxo-2,7-diazaspiro[4.5]decane-7-carboxamide is sourced from PubChem (CID 164633869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).