N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide

C16H25N5O2 — CID 118741028

IUPACN,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCN(C)C(=O)N1CCC2(CC1)C(c1cnn(C)c1)CC(=O)N2C
InChIInChI=1S/C16H25N5O2/c1-18(2)15(23)21-7-5-16(6-8-21)13(9-14(22)20(16)4)12-10-17-19(3)11-12/h10-11,13H,5-9H2,1-4H3
InChIKeySFBMFZMVWUIZGD-UHFFFAOYSA-N
MW319.41 g/mol
LogP0.88
Rot. Bonds1

About N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide

N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide (PubChem CID 118741028) has the molecular formula C16H25N5O2 and a molecular weight of 319.41 g/mol. Its IUPAC name is N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound NameN,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide
PubChem CID118741028
Molecular FormulaC16H25N5O2
Molecular Weight319.41 g/mol
Exact Mass319.20
IUPAC NameN,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide
SMILESCN(C)C(=O)N1CCC2(CC1)C(c1cnn(C)c1)CC(=O)N2C
InChIInChI=1S/C16H25N5O2/c1-18(2)15(23)21-7-5-16(6-8-21)13(9-14(22)20(16)4)12-10-17-19(3)11-12/h10-11,13H,5-9H2,1-4H3
InChIKeySFBMFZMVWUIZGD-UHFFFAOYSA-N
XLogP0.88
TPSA61.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide?
The IUPAC name of N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide (CID 118741028) is N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide is CN(C)C(=O)N1CCC2(CC1)C(c1cnn(C)c1)CC(=O)N2C.
What is the InChIKey of N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide?
The InChIKey is SFBMFZMVWUIZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O2/c1-18(2)15(23)21-7-5-16(6-8-21)13(9-14(22)20(16)4)12-10-17-19(3)11-12/h10-11,13H,5-9H2,1-4H3.
What are the key properties of N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide?
N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide has a molecular weight of 319.41 g/mol, XLogP of 0.88, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1-trimethyl-4-(1-methylpyrazol-4-yl)-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 118741028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).