1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one

C17H23N3O3 — CID 97493798

IUPAC1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one
SMILESCc1nocc1C(=O)N1CCC2(CCC(=O)N2CC2CC2)CC1
InChIInChI=1S/C17H23N3O3/c1-12-14(11-23-18-12)16(22)19-8-6-17(7-9-19)5-4-15(21)20(17)10-13-2-3-13/h11,13H,2-10H2,1H3
InChIKeyGSLAVFAHJTXCPM-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.99
Rot. Bonds3

About 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one

1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one (PubChem CID 97493798) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one
PubChem CID97493798
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one
SMILESCc1nocc1C(=O)N1CCC2(CCC(=O)N2CC2CC2)CC1
InChIInChI=1S/C17H23N3O3/c1-12-14(11-23-18-12)16(22)19-8-6-17(7-9-19)5-4-15(21)20(17)10-13-2-3-13/h11,13H,2-10H2,1H3
InChIKeyGSLAVFAHJTXCPM-UHFFFAOYSA-N
XLogP1.99
TPSA66.65 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(cyclopropylmethyl)-8-(1-methylpyrazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one
CID 97493786
1-ethyl-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[5.5]undecan-2-one
CID 118739664
ethyl 4-(3-methyl-1,2-oxazole-4-carbonyl)piperazine-1-carboxylate
CID 110853959
N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-5-methyl-1,2-oxazole-4-carboxamide
CID 97397451
[3-(dimethylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-1,2-oxazol-4-yl)methanone
CID 131651452
N-benzyl-1-(cyclopropylmethyl)-2-oxo-1,9-diazaspiro[4.6]undecane-9-carboxamide
CID 131661655
1-benzyl-8-(2-methylfuran-3-carbonyl)-1,8-diazaspiro[4.5]decan-2-one
CID 97493907
2-(cyclopropylmethyl)-9-(4-methylpyrimidine-5-carbonyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72859362
[(1R,2R)-2-methylcyclopropyl]-[7-(3-methyl-1,2-oxazole-4-carbonyl)-3-propan-2-yl-2,7-diazaspiro[3.5]nonan-2-yl]methanone
CID 167772991
N-[1-(cyclopropylmethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-(4-methylphenyl)acetamide
CID 97397454
(6S)-10-(cyclopropylmethyl)-4-(2,4-dimethylpyrimidine-5-carbonyl)-1-methyl-1,4,10-triazaspiro[5.6]dodecan-9-one
CID 97200483
1-(cyclopropylmethyl)-8-pyridin-3-yl-1,8-diazaspiro[4.5]decan-2-one
CID 97493791

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one (CID 97493798) is 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one is Cc1nocc1C(=O)N1CCC2(CCC(=O)N2CC2CC2)CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one?
The InChIKey is GSLAVFAHJTXCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-12-14(11-23-18-12)16(22)19-8-6-17(7-9-19)5-4-15(21)20(17)10-13-2-3-13/h11,13H,2-10H2,1H3.
What are the key properties of 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one?
1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one has a molecular weight of 317.39 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-8-(3-methyl-1,2-oxazole-4-carbonyl)-1,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 97493798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).