N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide

C15H28N2O — CID 114875579

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide
SMILESCCC(C)CC(=O)N(CC)C1CC2CCC(C1)N2
InChIInChI=1S/C15H28N2O/c1-4-11(3)8-15(18)17(5-2)14-9-12-6-7-13(10-14)16-12/h11-14,16H,4-10H2,1-3H3
InChIKeyAMFJYYURNPWTNT-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.55
Rot. Bonds5

About N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide (PubChem CID 114875579) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide
PubChem CID114875579
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide
SMILESCCC(C)CC(=O)N(CC)C1CC2CCC(C1)N2
InChIInChI=1S/C15H28N2O/c1-4-11(3)8-15(18)17(5-2)14-9-12-6-7-13(10-14)16-12/h11-14,16H,4-10H2,1-3H3
InChIKeyAMFJYYURNPWTNT-UHFFFAOYSA-N
XLogP2.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylbutanamide
CID 61231318
1-(8-azabicyclo[3.2.1]octan-3-yl)-1,3,3-triethylurea
CID 79161480
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-2,2-difluoroacetamide
CID 103514114
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-tert-butylsulfanyl-N-ethylacetamide
CID 61230747
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpent-4-ynamide
CID 114028609
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-2-methylcyclopropane-1-carboxamide
CID 61232277
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpiperidine-1-carboxamide
CID 79155372
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-2-(2-oxopyrrolidin-1-yl)acetamide
CID 61231886
N-ethyl-3-methyl-N-piperidin-4-ylbutanamide
CID 60806063
N-(2-chloroethyl)-N-cyclohexyl-3-methylpentanamide
CID 114876819
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyloxolane-3-carboxamide
CID 61271461
ethyl 2-[acetyl-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]amino]acetate
CID 59577523

Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide (CID 114875579) is N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide is CCC(C)CC(=O)N(CC)C1CC2CCC(C1)N2.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide?
The InChIKey is AMFJYYURNPWTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-4-11(3)8-15(18)17(5-2)14-9-12-6-7-13(10-14)16-12/h11-14,16H,4-10H2,1-3H3.
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide?
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide has a molecular weight of 252.40 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-3-methylpentanamide is sourced from PubChem (CID 114875579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).