5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine

C15H25N5 — CID 56712809

IUPAC5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine
SMILESCN(C)c1ncc(CN2CCC3(CCNCC3)C2)cn1
InChIInChI=1S/C15H25N5/c1-19(2)14-17-9-13(10-18-14)11-20-8-5-15(12-20)3-6-16-7-4-15/h9-10,16H,3-8,11-12H2,1-2H3
InChIKeyXXULEIVFTNXKEW-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.12
Rot. Bonds3

About 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine

5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine (PubChem CID 56712809) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine
PubChem CID56712809
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine
SMILESCN(C)c1ncc(CN2CCC3(CCNCC3)C2)cn1
InChIInChI=1S/C15H25N5/c1-19(2)14-17-9-13(10-18-14)11-20-8-5-15(12-20)3-6-16-7-4-15/h9-10,16H,3-8,11-12H2,1-2H3
InChIKeyXXULEIVFTNXKEW-UHFFFAOYSA-N
XLogP1.12
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine?
The IUPAC name of 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine (CID 56712809) is 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine.
What is the SMILES notation for 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine?
The canonical SMILES for 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine is CN(C)c1ncc(CN2CCC3(CCNCC3)C2)cn1.
What is the InChIKey of 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine?
The InChIKey is XXULEIVFTNXKEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-19(2)14-17-9-13(10-18-14)11-20-8-5-15(12-20)3-6-16-7-4-15/h9-10,16H,3-8,11-12H2,1-2H3.
What are the key properties of 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine?
5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine has a molecular weight of 275.40 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,8-diazaspiro[4.5]decan-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine is sourced from PubChem (CID 56712809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).