N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide

C17H24N2O4 — CID 78901451

IUPACN-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
SMILESO=C(NCCO)C1CCN(C(=O)CCOc2ccccc2)CC1
InChIInChI=1S/C17H24N2O4/c20-12-9-18-17(22)14-6-10-19(11-7-14)16(21)8-13-23-15-4-2-1-3-5-15/h1-5,14,20H,6-13H2,(H,18,22)
InChIKeySNLSQKDCGWOESD-UHFFFAOYSA-N
MW320.39 g/mol
LogP0.80
Rot. Bonds7

About N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide

N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide (PubChem CID 78901451) has the molecular formula C17H24N2O4 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
PubChem CID78901451
Molecular FormulaC17H24N2O4
Molecular Weight320.39 g/mol
Exact Mass320.17
IUPAC NameN-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
SMILESO=C(NCCO)C1CCN(C(=O)CCOc2ccccc2)CC1
InChIInChI=1S/C17H24N2O4/c20-12-9-18-17(22)14-6-10-19(11-7-14)16(21)8-13-23-15-4-2-1-3-5-15/h1-5,14,20H,6-13H2,(H,18,22)
InChIKeySNLSQKDCGWOESD-UHFFFAOYSA-N
XLogP0.80
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-phenoxypropanoyl)-N-(3-phenylpropyl)piperidine-4-carboxamide
CID 55854450
1-(3-phenoxypropanoyl)-N-prop-2-ynylpiperidine-4-carboxamide
CID 51087677
1-(3-phenoxypropanoyl)-N-(2-pyridin-3-ylethyl)piperidine-4-carboxamide
CID 55860208
N-[(4-chlorophenyl)methyl]-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 55853684
N-(2-amino-2-ethylbutyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 119643819
N-(3-amino-2-methylpropyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 119995540
N-[2-(1H-indol-3-yl)ethyl]-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 60520759
N-[3-(cyclopropanecarbonylamino)phenyl]-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 55885887
N-(4-acetamidophenyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 55854580
N-[(2S)-3-methylbutan-2-yl]-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 94521670
N-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 55885131
N-[2-(2-methoxy-5-methylphenyl)ethyl]-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 55856671

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide (CID 78901451) is N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide is O=C(NCCO)C1CCN(C(=O)CCOc2ccccc2)CC1.
What is the InChIKey of N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide?
The InChIKey is SNLSQKDCGWOESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O4/c20-12-9-18-17(22)14-6-10-19(11-7-14)16(21)8-13-23-15-4-2-1-3-5-15/h1-5,14,20H,6-13H2,(H,18,22).
What are the key properties of N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide?
N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide has a molecular weight of 320.39 g/mol, XLogP of 0.80, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 78901451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).