N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide

C13H25N3O3S — CID 95225447

IUPACN-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide
SMILESCN1CC[C@]2(CCCN(C(=O)CCNS(C)(=O)=O)C2)C1
InChIInChI=1S/C13H25N3O3S/c1-15-9-6-13(10-15)5-3-8-16(11-13)12(17)4-7-14-20(2,18)19/h14H,3-11H2,1-2H3/t13-/m1/s1
InChIKeyJWGJMOUXGSMYMP-CYBMUJFWSA-N
MW303.43 g/mol
LogP-0.13
Rot. Bonds4

About N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide

N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide (PubChem CID 95225447) has the molecular formula C13H25N3O3S and a molecular weight of 303.43 g/mol. Its IUPAC name is N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide.

Molecular Properties

Compound NameN-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide
PubChem CID95225447
Molecular FormulaC13H25N3O3S
Molecular Weight303.43 g/mol
Exact Mass303.16
IUPAC NameN-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide
SMILESCN1CC[C@]2(CCCN(C(=O)CCNS(C)(=O)=O)C2)C1
InChIInChI=1S/C13H25N3O3S/c1-15-9-6-13(10-15)5-3-8-16(11-13)12(17)4-7-14-20(2,18)19/h14H,3-11H2,1-2H3/t13-/m1/s1
InChIKeyJWGJMOUXGSMYMP-CYBMUJFWSA-N
XLogP-0.13
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide with MolForge

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Related Compounds

N-(3-oxo-3-piperidin-1-ylpropyl)methanesulfonamide
CID 47028347
N-[3-[(3R)-3-methylpiperidin-1-yl]-3-oxopropyl]methanesulfonamide
CID 94809178
1-(5-azaspiro[2.5]octan-5-yl)butan-1-one
CID 130890888
1-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-2-morpholin-4-ylethane-1,2-dione
CID 95213027
3-(azocan-1-yl)-1-(2-methyl-2,8-diazaspiro[4.5]decan-8-yl)propan-1-one
CID 50958689
1-[(6R)-2-azaspiro[5.5]undec-9-en-2-yl]-3-methylsulfonylpropan-1-one
CID 95627824
3,4-dimethyl-N-[2-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)-2-oxoethyl]benzenesulfonamide
CID 166235723
2-(4-methylcyclohexyl)-1-[(5S)-7-methyl-2,7-diazaspiro[4.4]nonan-2-yl]ethanone
CID 164633620
8-[2-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-2-oxoethyl]-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CID 166254738
[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-(5-methyl-1H-pyrazol-3-yl)methanone
CID 95229385
2-methyl-N-(2,4,5-trifluorophenyl)-2,7-diazaspiro[4.5]decane-7-carboxamide
CID 72861534
benzyl 2-methyl-2,7-diazaspiro[4.5]decane-7-carboxylate
CID 118883097

Frequently Asked Questions

What is the IUPAC name of N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide?
The IUPAC name of N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide (CID 95225447) is N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide.
What is the SMILES notation for N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide?
The canonical SMILES for N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide is CN1CC[C@]2(CCCN(C(=O)CCNS(C)(=O)=O)C2)C1.
What is the InChIKey of N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide?
The InChIKey is JWGJMOUXGSMYMP-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H25N3O3S/c1-15-9-6-13(10-15)5-3-8-16(11-13)12(17)4-7-14-20(2,18)19/h14H,3-11H2,1-2H3/t13-/m1/s1.
What are the key properties of N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide?
N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide has a molecular weight of 303.43 g/mol, XLogP of -0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(5R)-2-methyl-2,7-diazaspiro[4.5]decan-7-yl]-3-oxopropyl]methanesulfonamide is sourced from PubChem (CID 95225447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).