7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide

C19H33N3O2 — CID 45237561

IUPAC7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CCCN(CC3CCCCC3)C2=O)C1
InChIInChI=1S/C19H33N3O2/c1-15(2)20-18(24)22-12-10-19(14-22)9-6-11-21(17(19)23)13-16-7-4-3-5-8-16/h15-16H,3-14H2,1-2H3,(H,20,24)
InChIKeyVABAOJCFOYDABQ-UHFFFAOYSA-N
MW335.49 g/mol
LogP3.00
Rot. Bonds3

About 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide

7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide (PubChem CID 45237561) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide.

Molecular Properties

Compound Name7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide
PubChem CID45237561
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC Name7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CCCN(CC3CCCCC3)C2=O)C1
InChIInChI=1S/C19H33N3O2/c1-15(2)20-18(24)22-12-10-19(14-22)9-6-11-21(17(19)23)13-16-7-4-3-5-8-16/h15-16H,3-14H2,1-2H3,(H,20,24)
InChIKeyVABAOJCFOYDABQ-UHFFFAOYSA-N
XLogP3.00
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide?
The IUPAC name of 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide (CID 45237561) is 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide.
What is the SMILES notation for 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide?
The canonical SMILES for 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide is CC(C)NC(=O)N1CCC2(CCCN(CC3CCCCC3)C2=O)C1.
What is the InChIKey of 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide?
The InChIKey is VABAOJCFOYDABQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O2/c1-15(2)20-18(24)22-12-10-19(14-22)9-6-11-21(17(19)23)13-16-7-4-3-5-8-16/h15-16H,3-14H2,1-2H3,(H,20,24).
What are the key properties of 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide?
7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide has a molecular weight of 335.49 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide is sourced from PubChem (CID 45237561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).