2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide

C18H32N2O — CID 106628941

IUPAC2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
SMILESCC(C)N(CC1CCCNC1)C(=O)CC1CC2CCC1C2
InChIInChI=1S/C18H32N2O/c1-13(2)20(12-15-4-3-7-19-11-15)18(21)10-17-9-14-5-6-16(17)8-14/h13-17,19H,3-12H2,1-2H3
InChIKeyFQOOWQGOXLHZCS-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.05
Rot. Bonds5

About 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide

2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide (PubChem CID 106628941) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
PubChem CID106628941
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC Name2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
SMILESCC(C)N(CC1CCCNC1)C(=O)CC1CC2CCC1C2
InChIInChI=1S/C18H32N2O/c1-13(2)20(12-15-4-3-7-19-11-15)18(21)10-17-9-14-5-6-16(17)8-14/h13-17,19H,3-12H2,1-2H3
InChIKeyFQOOWQGOXLHZCS-UHFFFAOYSA-N
XLogP3.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(oxolan-2-yl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
CID 106629086
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-propan-2-yloxyacetamide
CID 106628870
N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclobutanecarboxamide
CID 106629002
N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide
CID 106628895
N-(piperidin-3-ylmethyl)-N-propan-2-ylthiolane-2-carboxamide
CID 106629118
2-(2-hydroxyphenyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
CID 106629125
1-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentane-1-carboxamide
CID 106629148
2-(2-methylphenyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide
CID 106628910
3-cyclohexyl-1-(piperidin-3-ylmethyl)-1-propan-2-ylurea
CID 106629886
1-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexane-1-carboxamide
CID 106828147
3-imidazol-1-yl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropanamide
CID 106629196
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-pyrazol-1-ylacetamide
CID 106629183

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide (CID 106628941) is 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide is CC(C)N(CC1CCCNC1)C(=O)CC1CC2CCC1C2.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide?
The InChIKey is FQOOWQGOXLHZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c1-13(2)20(12-15-4-3-7-19-11-15)18(21)10-17-9-14-5-6-16(17)8-14/h13-17,19H,3-12H2,1-2H3.
What are the key properties of 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide?
2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide has a molecular weight of 292.47 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]heptanyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylacetamide is sourced from PubChem (CID 106628941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).