N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide

C18H34N2O — CID 106625676

IUPACN-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide
SMILESCCCN(CC1CCCCN1)C(=O)C1CCCCCCC1
InChIInChI=1S/C18H34N2O/c1-2-14-20(15-17-12-8-9-13-19-17)18(21)16-10-6-4-3-5-7-11-16/h16-17,19H,2-15H2,1H3
InChIKeyUPILVQJGOUIOOC-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.73
Rot. Bonds5

About N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide

N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide (PubChem CID 106625676) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide
PubChem CID106625676
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC NameN-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide
SMILESCCCN(CC1CCCCN1)C(=O)C1CCCCCCC1
InChIInChI=1S/C18H34N2O/c1-2-14-20(15-17-12-8-9-13-19-17)18(21)16-10-6-4-3-5-7-11-16/h16-17,19H,2-15H2,1H3
InChIKeyUPILVQJGOUIOOC-UHFFFAOYSA-N
XLogP3.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propyl-N-(pyrrolidin-2-ylmethyl)cyclobutanecarboxamide
CID 106610516
N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide
CID 106625572
1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide
CID 106625670
2-cycloheptyl-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625612
2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide
CID 106625536
N-methyl-N-(piperidin-2-ylmethyl)cycloheptanecarboxamide
CID 106627288
N-propyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106610345
2,2-difluoro-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625526
N-(piperidin-4-ylmethyl)-N-propylcyclooctanecarboxamide
CID 79702518
N-(2-hydroxyethyl)-4-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexane-1-carboxamide
CID 106612534
N-propyl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106610515
5-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide
CID 106610382

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide?
The IUPAC name of N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide (CID 106625676) is N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide?
The canonical SMILES for N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide is CCCN(CC1CCCCN1)C(=O)C1CCCCCCC1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide?
The InChIKey is UPILVQJGOUIOOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-2-14-20(15-17-12-8-9-13-19-17)18(21)16-10-6-4-3-5-7-11-16/h16-17,19H,2-15H2,1H3.
What are the key properties of N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide?
N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide has a molecular weight of 294.48 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide is sourced from PubChem (CID 106625676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).