2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide

C16H27N3O2 — CID 97370256

IUPAC2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN1CCC2(CCN(CC3CC3)CC2)C1=O
InChIInChI=1S/C16H27N3O2/c1-17(2)14(20)12-19-10-7-16(15(19)21)5-8-18(9-6-16)11-13-3-4-13/h13H,3-12H2,1-2H3
InChIKeyKXKDFXREGHBSDS-UHFFFAOYSA-N
MW293.41 g/mol
LogP0.80
Rot. Bonds4

About 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide

2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide (PubChem CID 97370256) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide
PubChem CID97370256
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN1CCC2(CCN(CC3CC3)CC2)C1=O
InChIInChI=1S/C16H27N3O2/c1-17(2)14(20)12-19-10-7-16(15(19)21)5-8-18(9-6-16)11-13-3-4-13/h13H,3-12H2,1-2H3
InChIKeyKXKDFXREGHBSDS-UHFFFAOYSA-N
XLogP0.80
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide?
The IUPAC name of 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide (CID 97370256) is 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide is CN(C)C(=O)CN1CCC2(CCN(CC3CC3)CC2)C1=O.
What is the InChIKey of 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide?
The InChIKey is KXKDFXREGHBSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-17(2)14(20)12-19-10-7-16(15(19)21)5-8-18(9-6-16)11-13-3-4-13/h13H,3-12H2,1-2H3.
What are the key properties of 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide?
2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide has a molecular weight of 293.41 g/mol, XLogP of 0.80, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide is sourced from PubChem (CID 97370256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).