N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide

C19H33N5O — CID 56909783

IUPACN-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide
SMILESCCCN1CC2(CCN(C)CC2)CC1C(=O)NCc1cc(C)nn1C
InChIInChI=1S/C19H33N5O/c1-5-8-24-14-19(6-9-22(3)10-7-19)12-17(24)18(25)20-13-16-11-15(2)21-23(16)4/h11,17H,5-10,12-14H2,1-4H3,(H,20,25)
InChIKeyIAZKDXZIIOUCKL-UHFFFAOYSA-N
MW347.51 g/mol
LogP1.54
Rot. Bonds5

About N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide

N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide (PubChem CID 56909783) has the molecular formula C19H33N5O and a molecular weight of 347.51 g/mol. Its IUPAC name is N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide.

Molecular Properties

Compound NameN-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide
PubChem CID56909783
Molecular FormulaC19H33N5O
Molecular Weight347.51 g/mol
Exact Mass347.27
IUPAC NameN-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide
SMILESCCCN1CC2(CCN(C)CC2)CC1C(=O)NCc1cc(C)nn1C
InChIInChI=1S/C19H33N5O/c1-5-8-24-14-19(6-9-22(3)10-7-19)12-17(24)18(25)20-13-16-11-15(2)21-23(16)4/h11,17H,5-10,12-14H2,1-4H3,(H,20,25)
InChIKeyIAZKDXZIIOUCKL-UHFFFAOYSA-N
XLogP1.54
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.51
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide?
The IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide (CID 56909783) is N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide.
What is the SMILES notation for N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide?
The canonical SMILES for N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide is CCCN1CC2(CCN(C)CC2)CC1C(=O)NCc1cc(C)nn1C.
What is the InChIKey of N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide?
The InChIKey is IAZKDXZIIOUCKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N5O/c1-5-8-24-14-19(6-9-22(3)10-7-19)12-17(24)18(25)20-13-16-11-15(2)21-23(16)4/h11,17H,5-10,12-14H2,1-4H3,(H,20,25).
What are the key properties of N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide?
N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide has a molecular weight of 347.51 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethylpyrazol-3-yl)methyl]-8-methyl-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 56909783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).