1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide

C23H26N2O2 — CID 9141961

IUPAC1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2ccc3c(c2)CCC3)(c2ccccc2)CC1
InChIInChI=1S/C23H26N2O2/c1-17(26)25-14-12-23(13-15-25,20-8-3-2-4-9-20)22(27)24-21-11-10-18-6-5-7-19(18)16-21/h2-4,8-11,16H,5-7,12-15H2,1H3,(H,24,27)
InChIKeyWMPMBPAWIWCVMJ-UHFFFAOYSA-N
MW362.47 g/mol
LogP3.69
Rot. Bonds3

About 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide

1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide (PubChem CID 9141961) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide
PubChem CID9141961
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC Name1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2ccc3c(c2)CCC3)(c2ccccc2)CC1
InChIInChI=1S/C23H26N2O2/c1-17(26)25-14-12-23(13-15-25,20-8-3-2-4-9-20)22(27)24-21-11-10-18-6-5-7-19(18)16-21/h2-4,8-11,16H,5-7,12-15H2,1H3,(H,24,27)
InChIKeyWMPMBPAWIWCVMJ-UHFFFAOYSA-N
XLogP3.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide (CID 9141961) is 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide is CC(=O)N1CCC(C(=O)Nc2ccc3c(c2)CCC3)(c2ccccc2)CC1.
What is the InChIKey of 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide?
The InChIKey is WMPMBPAWIWCVMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-17(26)25-14-12-23(13-15-25,20-8-3-2-4-9-20)22(27)24-21-11-10-18-6-5-7-19(18)16-21/h2-4,8-11,16H,5-7,12-15H2,1H3,(H,24,27).
What are the key properties of 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide?
1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide has a molecular weight of 362.47 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)-4-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 9141961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).