N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide

C23H25N3O2 — CID 14330362

IUPACN-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide
SMILESO=C(c1ccoc1)N(c1ccccn1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C23H25N3O2/c27-23(20-12-17-28-18-20)26(22-8-4-5-13-24-22)21-10-15-25(16-11-21)14-9-19-6-2-1-3-7-19/h1-8,12-13,17-18,21H,9-11,14-16H2
InChIKeyCMMOCMICHSXCHP-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.03
Rot. Bonds6

About N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide

N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide (PubChem CID 14330362) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide
PubChem CID14330362
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide
SMILESO=C(c1ccoc1)N(c1ccccn1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C23H25N3O2/c27-23(20-12-17-28-18-20)26(22-8-4-5-13-24-22)21-10-15-25(16-11-21)14-9-19-6-2-1-3-7-19/h1-8,12-13,17-18,21H,9-11,14-16H2
InChIKeyCMMOCMICHSXCHP-UHFFFAOYSA-N
XLogP4.03
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide?
The IUPAC name of N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide (CID 14330362) is N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide.
What is the SMILES notation for N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide?
The canonical SMILES for N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide is O=C(c1ccoc1)N(c1ccccn1)C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide?
The InChIKey is CMMOCMICHSXCHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c27-23(20-12-17-28-18-20)26(22-8-4-5-13-24-22)21-10-15-25(16-11-21)14-9-19-6-2-1-3-7-19/h1-8,12-13,17-18,21H,9-11,14-16H2.
What are the key properties of N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide?
N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 4.03, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyridin-2-ylfuran-3-carboxamide is sourced from PubChem (CID 14330362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).