N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide

C15H23N5O — CID 97449525

IUPACN,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCN(C)C(=O)N1CCC2(CC1)CCN(c1ncccn1)C2
InChIInChI=1S/C15H23N5O/c1-18(2)14(21)19-9-4-15(5-10-19)6-11-20(12-15)13-16-7-3-8-17-13/h3,7-8H,4-6,9-12H2,1-2H3
InChIKeyBSJLTRJSHBEDJS-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.45
Rot. Bonds1

About N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide

N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 97449525) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID97449525
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC NameN,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCN(C)C(=O)N1CCC2(CC1)CCN(c1ncccn1)C2
InChIInChI=1S/C15H23N5O/c1-18(2)14(21)19-9-4-15(5-10-19)6-11-20(12-15)13-16-7-3-8-17-13/h3,7-8H,4-6,9-12H2,1-2H3
InChIKeyBSJLTRJSHBEDJS-UHFFFAOYSA-N
XLogP1.45
TPSA52.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide (CID 97449525) is N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide is CN(C)C(=O)N1CCC2(CC1)CCN(c1ncccn1)C2.
What is the InChIKey of N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is BSJLTRJSHBEDJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-18(2)14(21)19-9-4-15(5-10-19)6-11-20(12-15)13-16-7-3-8-17-13/h3,7-8H,4-6,9-12H2,1-2H3.
What are the key properties of N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide?
N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.45, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 97449525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).