N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide

C13H25N3O — CID 3234223

IUPACN-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CCNCC2)CC1
InChIInChI=1S/C13H25N3O/c1-11(2)15-12(17)16-9-5-13(6-10-16)3-7-14-8-4-13/h11,14H,3-10H2,1-2H3,(H,15,17)
InChIKeyFVJUXPFPBSAAAZ-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.57
Rot. Bonds1

About N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide

N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide (PubChem CID 3234223) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide
PubChem CID3234223
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CCNCC2)CC1
InChIInChI=1S/C13H25N3O/c1-11(2)15-12(17)16-9-5-13(6-10-16)3-7-14-8-4-13/h11,14H,3-10H2,1-2H3,(H,15,17)
InChIKeyFVJUXPFPBSAAAZ-UHFFFAOYSA-N
XLogP1.57
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methylsulfonyl-N-propan-2-yl-3,9-diazaspiro[5.5]undecane-9-carboxamide
CID 3233596
Methyl 9-(propan-2-ylcarbamoyl)-3,9-diazaspiro[5.5]undecane-3-carboxylate
CID 3234502
2,4,9-Triazaspiro[5.5]undecan-3-one
CID 22386654
3-(dimethylamino)-N-(3,3-dimethylbutyl)piperidine-1-carboxamide
CID 72145167
N-propan-2-yl-1,8-diazaspiro[5.5]undecane-8-carboxamide
CID 118738744
3,3-Dimethyl-1-((1-methylpiperidin-4-yl)methyl)urea
CID 112688391
2-Ethyl-2,4,9-triazaspiro[5.5]undecan-3-one
CID 167731155
4-Methyl-2,4,9-triazaspiro[5.5]undecan-3-one
CID 177800747
N-butyl-4-methylpiperidine-1-carboxamide
CID 6467412
N-cyclohexyl-4-methylpiperidine-1-carboxamide
CID 4207227
1-[3-(4-Methylpiperidin-1-yl)propyl]-1,3-diazinan-2-one
CID 44374263
3-methyl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]piperidine-1-carboxamide
CID 86768320

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide?
The IUPAC name of N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide (CID 3234223) is N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide.
What is the SMILES notation for N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide?
The canonical SMILES for N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide is CC(C)NC(=O)N1CCC2(CCNCC2)CC1.
What is the InChIKey of N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide?
The InChIKey is FVJUXPFPBSAAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-11(2)15-12(17)16-9-5-13(6-10-16)3-7-14-8-4-13/h11,14H,3-10H2,1-2H3,(H,15,17).
What are the key properties of N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide?
N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 1.57, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-3,9-diazaspiro[5.5]undecane-3-carboxamide is sourced from PubChem (CID 3234223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).