N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide

C17H24N2O2 — CID 71193661

IUPACN,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide
SMILESCCN(CC)C(=O)C1OC2(CCNCC2)c2ccccc21
InChIInChI=1S/C17H24N2O2/c1-3-19(4-2)16(20)15-13-7-5-6-8-14(13)17(21-15)9-11-18-12-10-17/h5-8,15,18H,3-4,9-12H2,1-2H3
InChIKeyYJXHBXNUKULYIM-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.20
Rot. Bonds3

About N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide

N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide (PubChem CID 71193661) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide.

Molecular Properties

Compound NameN,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide
PubChem CID71193661
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide
SMILESCCN(CC)C(=O)C1OC2(CCNCC2)c2ccccc21
InChIInChI=1S/C17H24N2O2/c1-3-19(4-2)16(20)15-13-7-5-6-8-14(13)17(21-15)9-11-18-12-10-17/h5-8,15,18H,3-4,9-12H2,1-2H3
InChIKeyYJXHBXNUKULYIM-UHFFFAOYSA-N
XLogP2.20
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide?
The IUPAC name of N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide (CID 71193661) is N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide.
What is the SMILES notation for N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide?
The canonical SMILES for N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide is CCN(CC)C(=O)C1OC2(CCNCC2)c2ccccc21.
What is the InChIKey of N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide?
The InChIKey is YJXHBXNUKULYIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-3-19(4-2)16(20)15-13-7-5-6-8-14(13)17(21-15)9-11-18-12-10-17/h5-8,15,18H,3-4,9-12H2,1-2H3.
What are the key properties of N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide?
N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylspiro[1H-2-benzofuran-3,4'-piperidine]-1-carboxamide is sourced from PubChem (CID 71193661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).