4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide

C20H31N3O3 — CID 51124416

IUPAC4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide
SMILESCCOC1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)CC1
InChIInChI=1S/C20H31N3O3/c1-2-26-19-7-9-23(10-8-19)20(24)21-15-17-3-5-18(6-4-17)16-22-11-13-25-14-12-22/h3-6,19H,2,7-16H2,1H3,(H,21,24)
InChIKeyZANWEVNBEPVVPW-UHFFFAOYSA-N
MW361.49 g/mol
LogP2.23
Rot. Bonds6

About 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide

4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide (PubChem CID 51124416) has the molecular formula C20H31N3O3 and a molecular weight of 361.49 g/mol. Its IUPAC name is 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide
PubChem CID51124416
Molecular FormulaC20H31N3O3
Molecular Weight361.49 g/mol
Exact Mass361.24
IUPAC Name4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide
SMILESCCOC1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)CC1
InChIInChI=1S/C20H31N3O3/c1-2-26-19-7-9-23(10-8-19)20(24)21-15-17-3-5-18(6-4-17)16-22-11-13-25-14-12-22/h3-6,19H,2,7-16H2,1H3,(H,21,24)
InChIKeyZANWEVNBEPVVPW-UHFFFAOYSA-N
XLogP2.23
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.49
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide?
The IUPAC name of 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide (CID 51124416) is 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide?
The canonical SMILES for 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide is CCOC1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)CC1.
What is the InChIKey of 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide?
The InChIKey is ZANWEVNBEPVVPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O3/c1-2-26-19-7-9-23(10-8-19)20(24)21-15-17-3-5-18(6-4-17)16-22-11-13-25-14-12-22/h3-6,19H,2,7-16H2,1H3,(H,21,24).
What are the key properties of 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide?
4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide has a molecular weight of 361.49 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-1-carboxamide is sourced from PubChem (CID 51124416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).