N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide

C19H28N2O3 — CID 124619395

IUPACN-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide
SMILESCO[C@@H](CNC(=O)N1CCC([C@H]2CCCO2)CC1)c1ccccc1
InChIInChI=1S/C19H28N2O3/c1-23-18(15-6-3-2-4-7-15)14-20-19(22)21-11-9-16(10-12-21)17-8-5-13-24-17/h2-4,6-7,16-18H,5,8-14H2,1H3,(H,20,22)/t17-,18+/m1/s1
InChIKeyHWQPEWJDQRCPAO-MSOLQXFVSA-N
MW332.44 g/mol
LogP2.97
Rot. Bonds5

About N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide

N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide (PubChem CID 124619395) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide
PubChem CID124619395
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide
SMILESCO[C@@H](CNC(=O)N1CCC([C@H]2CCCO2)CC1)c1ccccc1
InChIInChI=1S/C19H28N2O3/c1-23-18(15-6-3-2-4-7-15)14-20-19(22)21-11-9-16(10-12-21)17-8-5-13-24-17/h2-4,6-7,16-18H,5,8-14H2,1H3,(H,20,22)/t17-,18+/m1/s1
InChIKeyHWQPEWJDQRCPAO-MSOLQXFVSA-N
XLogP2.97
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide?
The IUPAC name of N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide (CID 124619395) is N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide.
What is the SMILES notation for N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide?
The canonical SMILES for N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide is CO[C@@H](CNC(=O)N1CCC([C@H]2CCCO2)CC1)c1ccccc1.
What is the InChIKey of N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide?
The InChIKey is HWQPEWJDQRCPAO-MSOLQXFVSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-23-18(15-6-3-2-4-7-15)14-20-19(22)21-11-9-16(10-12-21)17-8-5-13-24-17/h2-4,6-7,16-18H,5,8-14H2,1H3,(H,20,22)/t17-,18+/m1/s1.
What are the key properties of N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide?
N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide has a molecular weight of 332.44 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-methoxy-2-phenylethyl]-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide is sourced from PubChem (CID 124619395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).