2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide

C17H32N2O2 — CID 106625536

IUPAC2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide
SMILESCCCN(CC1CCCCN1)C(=O)C1C(C)OC(C)C1C
InChIInChI=1S/C17H32N2O2/c1-5-10-19(11-15-8-6-7-9-18-15)17(20)16-12(2)13(3)21-14(16)4/h12-16,18H,5-11H2,1-4H3
InChIKeyKTPPVOSUKZWFHB-UHFFFAOYSA-N
MW296.45 g/mol
LogP2.43
Rot. Bonds5

About 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide

2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide (PubChem CID 106625536) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide.

Molecular Properties

Compound Name2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide
PubChem CID106625536
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC Name2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide
SMILESCCCN(CC1CCCCN1)C(=O)C1C(C)OC(C)C1C
InChIInChI=1S/C17H32N2O2/c1-5-10-19(11-15-8-6-7-9-18-15)17(20)16-12(2)13(3)21-14(16)4/h12-16,18H,5-11H2,1-4H3
InChIKeyKTPPVOSUKZWFHB-UHFFFAOYSA-N
XLogP2.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-2-ylmethyl)-N-propylcyclooctanecarboxamide
CID 106625676
5-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)oxolane-2-carboxamide
CID 106610382
N-(piperidin-2-ylmethyl)-N-propylbicyclo[3.1.0]hexane-3-carboxamide
CID 106625572
N-propyl-N-(pyrrolidin-2-ylmethyl)cyclobutanecarboxamide
CID 106610516
1-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrrolidine-3-carboxamide
CID 106625670
N-propyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106610345
2,2-difluoro-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625526
methyl 2-[propyl-(2,4,5-trimethyloxolane-3-carbonyl)amino]acetate
CID 65160300
2-cycloheptyl-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625612
N-propyl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106610515
4-methyl-N-(piperidin-2-ylmethyl)-N-propylpiperidine-1-carboxamide
CID 106629827
N-(3-aminopropyl)-2,4,5-trimethyl-N-propyloxolane-3-carboxamide
CID 65152019

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide?
The IUPAC name of 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide (CID 106625536) is 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide.
What is the SMILES notation for 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide?
The canonical SMILES for 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide is CCCN(CC1CCCCN1)C(=O)C1C(C)OC(C)C1C.
What is the InChIKey of 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide?
The InChIKey is KTPPVOSUKZWFHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-5-10-19(11-15-8-6-7-9-18-15)17(20)16-12(2)13(3)21-14(16)4/h12-16,18H,5-11H2,1-4H3.
What are the key properties of 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide?
2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide has a molecular weight of 296.45 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide is sourced from PubChem (CID 106625536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).