2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide

C12H22N2O2 — CID 107585114

IUPAC2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide
SMILESCC1CNCC(NC(=O)C2CCOC2C)C1
InChIInChI=1S/C12H22N2O2/c1-8-5-10(7-13-6-8)14-12(15)11-3-4-16-9(11)2/h8-11,13H,3-7H2,1-2H3,(H,14,15)
InChIKeyFRDYKEHORCKVTR-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.53
Rot. Bonds2

About 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide

2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide (PubChem CID 107585114) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide
PubChem CID107585114
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide
SMILESCC1CNCC(NC(=O)C2CCOC2C)C1
InChIInChI=1S/C12H22N2O2/c1-8-5-10(7-13-6-8)14-12(15)11-3-4-16-9(11)2/h8-11,13H,3-7H2,1-2H3,(H,14,15)
InChIKeyFRDYKEHORCKVTR-UHFFFAOYSA-N
XLogP0.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[(3R)-pyrrolidin-3-yl]oxolane-3-carboxamide
CID 79763327
N-(5-methylpiperidin-3-yl)cyclopropanecarboxamide
CID 173311262
2-methyl-N-(4-methylpyrrolidin-3-yl)oxolane-3-carboxamide
CID 104826208
2-methyl-N-(2-methylpiperidin-4-yl)oxolane-3-carboxamide
CID 106995532
2-methyl-N-(4-oxocyclohexyl)oxolane-3-carboxamide
CID 79759873
1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea
CID 107585278
2-methyl-N-(5-methylpiperidin-3-yl)propanamide
CID 107585162
N-ethyl-2-methyloxolane-3-carboxamide
CID 79758522
2,2-dimethyl-N-(5-methylpiperidin-3-yl)cyclopentane-1-carboxamide
CID 107585034
N-(3-methylcyclobutyl)oxetane-2-carboxamide
CID 130660475
2-[(2-methyloxolane-3-carbonyl)amino]acetic acid
CID 79750229
2-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-3-carboxamide
CID 79760319

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide?
The IUPAC name of 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide (CID 107585114) is 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide?
The canonical SMILES for 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide is CC1CNCC(NC(=O)C2CCOC2C)C1.
What is the InChIKey of 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide?
The InChIKey is FRDYKEHORCKVTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-8-5-10(7-13-6-8)14-12(15)11-3-4-16-9(11)2/h8-11,13H,3-7H2,1-2H3,(H,14,15).
What are the key properties of 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide?
2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide is sourced from PubChem (CID 107585114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).