1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one

C17H26N4O2 — CID 162629731

IUPAC1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one
SMILESCc1c(C(=O)N2CCCC23CCCN(C(C)C)C3=O)cnn1C
InChIInChI=1S/C17H26N4O2/c1-12(2)20-9-5-7-17(16(20)23)8-6-10-21(17)15(22)14-11-18-19(4)13(14)3/h11-12H,5-10H2,1-4H3
InChIKeyMHERUUDNRRXONA-UHFFFAOYSA-N
MW318.42 g/mol
LogP1.73
Rot. Bonds2

About 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one

1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 162629731) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one
PubChem CID162629731
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC Name1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one
SMILESCc1c(C(=O)N2CCCC23CCCN(C(C)C)C3=O)cnn1C
InChIInChI=1S/C17H26N4O2/c1-12(2)20-9-5-7-17(16(20)23)8-6-10-21(17)15(22)14-11-18-19(4)13(14)3/h11-12H,5-10H2,1-4H3
InChIKeyMHERUUDNRRXONA-UHFFFAOYSA-N
XLogP1.73
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-methoxy-2-methylpyridine-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one
CID 163309851
9-propan-2-yl-1-(1-propan-2-ylpyrazole-4-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162630006
1-(6-ethyl-1,5-dimethyl-2-oxopyridine-3-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one
CID 162632734
1-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one
CID 162634819
9-propan-2-yl-1-[3-(1H-pyrazol-4-yl)benzoyl]-1,9-diazaspiro[4.5]decan-10-one
CID 163316785
4-methyl-2-[2-oxo-2-(10-oxo-9-propan-2-yl-1,9-diazaspiro[4.5]decan-1-yl)ethyl]phthalazin-1-one
CID 162627058
1-[4-(1,5-dimethylpyrazole-4-carbonyl)piperazin-1-yl]-2-methylpropan-1-one
CID 47136455
4-(1,5-dimethylpyrazole-4-carbonyl)piperazine-2,6-dione
CID 66085561
methyl 4-[(10-oxo-9-propan-2-yl-1,9-diazaspiro[4.5]decane-1-carbonyl)amino]benzoate
CID 162632566
1-[2-(3-fluoro-4-hydroxyphenyl)acetyl]-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one
CID 162629332
9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
CID 163316091
1-(3,5-dimethyl-1-propan-2-ylpyrazole-4-carbonyl)-9-propyl-1,9-diazaspiro[4.5]decan-10-one
CID 162637228

Frequently Asked Questions

What is the IUPAC name of 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one (CID 162629731) is 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one is Cc1c(C(=O)N2CCCC23CCCN(C(C)C)C3=O)cnn1C.
What is the InChIKey of 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is MHERUUDNRRXONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O2/c1-12(2)20-9-5-7-17(16(20)23)8-6-10-21(17)15(22)14-11-18-19(4)13(14)3/h11-12H,5-10H2,1-4H3.
What are the key properties of 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one?
1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 318.42 g/mol, XLogP of 1.73, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,5-dimethylpyrazole-4-carbonyl)-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 162629731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).