2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide

C17H30N2O — CID 106625989

IUPAC2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide
SMILESCCN(CC1CCCCN1)C(=O)CC1CC2CCC1C2
InChIInChI=1S/C17H30N2O/c1-2-19(12-16-5-3-4-8-18-16)17(20)11-15-10-13-6-7-14(15)9-13/h13-16,18H,2-12H2,1H3
InChIKeyMQYVHVUTMKLIFF-UHFFFAOYSA-N
MW278.44 g/mol
LogP2.80
Rot. Bonds5

About 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide

2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide (PubChem CID 106625989) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide
PubChem CID106625989
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC Name2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide
SMILESCCN(CC1CCCCN1)C(=O)CC1CC2CCC1C2
InChIInChI=1S/C17H30N2O/c1-2-19(12-16-5-3-4-8-18-16)17(20)11-15-10-13-6-7-14(15)9-13/h13-16,18H,2-12H2,1H3
InChIKeyMQYVHVUTMKLIFF-UHFFFAOYSA-N
XLogP2.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bicyclo[2.2.1]heptanyl)-N-methyl-N-(2-piperidin-2-ylethyl)acetamide
CID 43187162
2-cyclohexyl-N-ethyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106609305
N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide
CID 107398386
1,3-diethyl-1-(piperidin-2-ylmethyl)urea
CID 106629771
2-cycloheptyl-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625612
2-(2-bicyclo[2.2.1]heptanyl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 55084483
2-(2-bicyclo[2.2.1]heptanyl)-N,N-dimethylacetamide
CID 42910279
N-cyclopropyl-N-(piperidin-2-ylmethyl)acetamide
CID 66569474
3-(2,2-difluoroethoxy)-N-ethyl-N-(piperidin-2-ylmethyl)propanamide
CID 106626231
N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 106611174
N-ethyl-3-imidazol-1-yl-N-(piperidin-2-ylmethyl)propanamide
CID 106626307
2-acetamido-N-ethyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106609477

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide (CID 106625989) is 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide is CCN(CC1CCCCN1)C(=O)CC1CC2CCC1C2.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide?
The InChIKey is MQYVHVUTMKLIFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c1-2-19(12-16-5-3-4-8-18-16)17(20)11-15-10-13-6-7-14(15)9-13/h13-16,18H,2-12H2,1H3.
What are the key properties of 2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide?
2-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-N-(piperidin-2-ylmethyl)acetamide has a molecular weight of 278.44 g/mol, XLogP of 2.80, 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-ethyl-N-(piperidin-2-ylmethyl)acetamide is sourced from PubChem (CID 106625989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).