N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide

C17H24N2O2 — CID 82260254

IUPACN-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(CC2CCNCC2)cc1)C1CCCO1
InChIInChI=1S/C17H24N2O2/c20-17(16-2-1-11-21-16)19-15-5-3-13(4-6-15)12-14-7-9-18-10-8-14/h3-6,14,16,18H,1-2,7-12H2,(H,19,20)
InChIKeyCUKPCIHWESENGP-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.35
Rot. Bonds4

About N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide

N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide (PubChem CID 82260254) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide
PubChem CID82260254
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(CC2CCNCC2)cc1)C1CCCO1
InChIInChI=1S/C17H24N2O2/c20-17(16-2-1-11-21-16)19-15-5-3-13(4-6-15)12-14-7-9-18-10-8-14/h3-6,14,16,18H,1-2,7-12H2,(H,19,20)
InChIKeyCUKPCIHWESENGP-UHFFFAOYSA-N
XLogP2.35
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(bromomethyl)phenyl]oxolane-2-carboxamide
CID 114310850
N-[2-ethoxy-4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide
CID 82260265
N-[4-[2-(cyclopropylamino)-2-oxoethyl]phenyl]oxolane-2-carboxamide
CID 131950649
N-[4-(2-oxo-2-pyrrolidin-1-ylethyl)phenyl]oxolane-2-carboxamide
CID 110353088
N-[4-(aminomethyl)phenyl]oxane-2-carboxamide
CID 62214191
N-[4-(oxolane-2-carbonylamino)phenyl]piperidine-3-carboxamide
CID 119282784
N-[4-(2-hydroxyethyl)phenyl]oxane-2-carboxamide
CID 62212827
N-phenyloxolane-2-carboxamide
CID 3453643
N-[4-(4-aminobutyl)phenyl]oxolane-2-carboxamide
CID 82260089
3-[4-(oxane-2-carbonylamino)phenyl]propanoic acid
CID 115339436
N-[4-[(4-fluorophenyl)methylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 4198331
N-[4-(ethylaminomethyl)phenyl]oxane-2-carboxamide
CID 106910070

Frequently Asked Questions

What is the IUPAC name of N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide (CID 82260254) is N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide is O=C(Nc1ccc(CC2CCNCC2)cc1)C1CCCO1.
What is the InChIKey of N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide?
The InChIKey is CUKPCIHWESENGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c20-17(16-2-1-11-21-16)19-15-5-3-13(4-6-15)12-14-7-9-18-10-8-14/h3-6,14,16,18H,1-2,7-12H2,(H,19,20).
What are the key properties of N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide?
N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(piperidin-4-ylmethyl)phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 82260254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).