7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one

C17H26N4O3S — CID 72851233

IUPAC7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one
SMILESCCn1cc(S(=O)(=O)N2CCC3(CCCN(CC4CC4)C3=O)C2)cn1
InChIInChI=1S/C17H26N4O3S/c1-2-20-12-15(10-18-20)25(23,24)21-9-7-17(13-21)6-3-8-19(16(17)22)11-14-4-5-14/h10,12,14H,2-9,11,13H2,1H3
InChIKeyYFZVGTUIXKWNFZ-UHFFFAOYSA-N
MW366.49 g/mol
LogP1.32
Rot. Bonds5

About 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one

7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 72851233) has the molecular formula C17H26N4O3S and a molecular weight of 366.49 g/mol. Its IUPAC name is 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one
PubChem CID72851233
Molecular FormulaC17H26N4O3S
Molecular Weight366.49 g/mol
Exact Mass366.17
IUPAC Name7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one
SMILESCCn1cc(S(=O)(=O)N2CCC3(CCCN(CC4CC4)C3=O)C2)cn1
InChIInChI=1S/C17H26N4O3S/c1-2-20-12-15(10-18-20)25(23,24)21-9-7-17(13-21)6-3-8-19(16(17)22)11-14-4-5-14/h10,12,14H,2-9,11,13H2,1H3
InChIKeyYFZVGTUIXKWNFZ-UHFFFAOYSA-N
XLogP1.32
TPSA75.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.49
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-isopropyl-2-[(1-propyl-1H-pyrazol-5-yl)sulfonyl]-2,7-diazaspiro[4.5]decan-6-one
CID 72847978
2-[(1-ethyl-1H-pyrazol-5-yl)sulfonyl]-7-isopropyl-2,7-diazaspiro[4.5]decan-6-one
CID 72906404
7-(cyclobutylmethyl)-2-[(1-ethyl-1H-pyrazol-4-yl)sulfonyl]-2,7-diazaspiro[4.5]decan-6-one
CID 72935620
2-(3-methylbutyl)-8-[(1-methyl-1H-pyrazol-4-yl)sulfonyl]-2,8-diazaspiro[5.5]undecan-3-one
CID 72843860
3-(4-methyl-1H-pyrazol-1-yl)-1-{3-[1-(methylsulfonyl)-4-piperidyl]-1-pyrrolidinyl}-1-propanone
CID 91910349
1-[(1-Ethyl-1H-pyrazol-4-YL)sulfonyl]-8-methyl-tetradecahydrocyclopenta[B]1,5-diazacycloundecan-9-one
CID 110199435
5-{1-[(1-Ethyl-1H-pyrazol-4-YL)sulfonyl]piperidine-4-carbonyl}-1,5-diazacycloundecan-2-one
CID 110201741
2-cyclopropyl-9-[(1-ethyl-1H-pyrazol-4-yl)sulfonyl]-2,9-diazaspiro[5.5]undecan-3-one
CID 72856561
9-[(1-ethyl-1H-pyrazol-4-yl)sulfonyl]-2-isopropyl-2,9-diazaspiro[5.5]undecan-3-one
CID 72869808
(5S)-7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one
CID 97114479
(5S)-7-(cyclopropylmethyl)-2-(2-ethylpyrazol-3-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one
CID 97149981
1-[(1-Ethyl-1H-pyrazol-4-YL)sulfonyl]-4-fluoro-4-(pyrrolidine-1-carbonyl)piperidine
CID 124053463

Frequently Asked Questions

What is the IUPAC name of 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one (CID 72851233) is 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one is CCn1cc(S(=O)(=O)N2CCC3(CCCN(CC4CC4)C3=O)C2)cn1.
What is the InChIKey of 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is YFZVGTUIXKWNFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O3S/c1-2-20-12-15(10-18-20)25(23,24)21-9-7-17(13-21)6-3-8-19(16(17)22)11-14-4-5-14/h10,12,14H,2-9,11,13H2,1H3.
What are the key properties of 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one?
7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 366.49 g/mol, XLogP of 1.32, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopropylmethyl)-2-(1-ethylpyrazol-4-yl)sulfonyl-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 72851233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).