2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one

C14H23N3O2 — CID 97370126

IUPAC2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCN1CCC2(CCN(C(=O)N3CCCC3)CC2)C1=O
InChIInChI=1S/C14H23N3O2/c1-15-9-4-14(12(15)18)5-10-17(11-6-14)13(19)16-7-2-3-8-16/h2-11H2,1H3
InChIKeyKGRQQNWQPKWASN-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.15
Rot. Bonds

About 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one

2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one (PubChem CID 97370126) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one
PubChem CID97370126
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCN1CCC2(CCN(C(=O)N3CCCC3)CC2)C1=O
InChIInChI=1S/C14H23N3O2/c1-15-9-4-14(12(15)18)5-10-17(11-6-14)13(19)16-7-2-3-8-16/h2-11H2,1H3
InChIKeyKGRQQNWQPKWASN-UHFFFAOYSA-N
XLogP1.15
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one?
The IUPAC name of 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one (CID 97370126) is 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one is CN1CCC2(CCN(C(=O)N3CCCC3)CC2)C1=O.
What is the InChIKey of 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one?
The InChIKey is KGRQQNWQPKWASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-15-9-4-14(12(15)18)5-10-17(11-6-14)13(19)16-7-2-3-8-16/h2-11H2,1H3.
What are the key properties of 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one?
2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one has a molecular weight of 265.36 g/mol, XLogP of 1.15, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 97370126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).