5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide

C13H24N2O2 — CID 114699971

IUPAC5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide
SMILESCC1CCC(C(=O)NCC2CCNCC2C)O1
InChIInChI=1S/C13H24N2O2/c1-9-7-14-6-5-11(9)8-15-13(16)12-4-3-10(2)17-12/h9-12,14H,3-8H2,1-2H3,(H,15,16)
InChIKeyVBEPKZXSFFXVRZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.92
Rot. Bonds3

About 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide

5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide (PubChem CID 114699971) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide
PubChem CID114699971
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide
SMILESCC1CCC(C(=O)NCC2CCNCC2C)O1
InChIInChI=1S/C13H24N2O2/c1-9-7-14-6-5-11(9)8-15-13(16)12-4-3-10(2)17-12/h9-12,14H,3-8H2,1-2H3,(H,15,16)
InChIKeyVBEPKZXSFFXVRZ-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(3R,4S)-3-methylpiperidin-4-yl]methyl]acetamide
CID 129381532
5-methyl-N-(2-pyrrolidin-3-ylethyl)oxolane-2-carboxamide
CID 81331227
5-methyl-N-(2-piperidin-3-ylethyl)oxolane-2-carboxamide
CID 81331259
3,3-difluoro-N-[(3-methylpiperidin-4-yl)methyl]cyclopentane-1-carboxamide
CID 114226274
N-[(2-bromocyclohexyl)methyl]-5-methyloxolane-2-carboxamide
CID 114312330
N-[(3-methylpiperidin-4-yl)methyl]-1,1-dioxothiane-2-carboxamide
CID 114699924
propan-2-yl N-[(3-methylpiperidin-4-yl)methyl]carbamate
CID 114700132
3-methoxy-3-methyl-N-[(3-methylpiperidin-4-yl)methyl]butanamide
CID 103019709
1-cyclooctyl-3-[(3-methylpiperidin-4-yl)methyl]urea
CID 166259351
N-[(2-methylcyclopropyl)methyl]pyrrolidine-3-carboxamide
CID 115738405
1-[(3-methylpiperidin-4-yl)methyl]-3-(oxolan-3-yl)urea
CID 114700112
N-[(3-bromocyclopentyl)methyl]-5-methyloxolane-2-carboxamide
CID 106128505

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide?
The IUPAC name of 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide (CID 114699971) is 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide?
The canonical SMILES for 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide is CC1CCC(C(=O)NCC2CCNCC2C)O1.
What is the InChIKey of 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide?
The InChIKey is VBEPKZXSFFXVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-9-7-14-6-5-11(9)8-15-13(16)12-4-3-10(2)17-12/h9-12,14H,3-8H2,1-2H3,(H,15,16).
What are the key properties of 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide?
5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(3-methylpiperidin-4-yl)methyl]oxolane-2-carboxamide is sourced from PubChem (CID 114699971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).