N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide

C17H30N2O3 — CID 164641617

IUPACN-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide
SMILESO=C(CN1CCOC[C@@H]1CC1CCOCC1)NC1CCCC1
InChIInChI=1S/C17H30N2O3/c20-17(18-15-3-1-2-4-15)12-19-7-10-22-13-16(19)11-14-5-8-21-9-6-14/h14-16H,1-13H2,(H,18,20)/t16-/m0/s1
InChIKeyJMDLCCQSPDGGKS-INIZCTEOSA-N
MW310.44 g/mol
LogP1.56
Rot. Bonds5

About N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide

N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide (PubChem CID 164641617) has the molecular formula C17H30N2O3 and a molecular weight of 310.44 g/mol. Its IUPAC name is N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide
PubChem CID164641617
Molecular FormulaC17H30N2O3
Molecular Weight310.44 g/mol
Exact Mass310.23
IUPAC NameN-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide
SMILESO=C(CN1CCOC[C@@H]1CC1CCOCC1)NC1CCCC1
InChIInChI=1S/C17H30N2O3/c20-17(18-15-3-1-2-4-15)12-19-7-10-22-13-16(19)11-14-5-8-21-9-6-14/h14-16H,1-13H2,(H,18,20)/t16-/m0/s1
InChIKeyJMDLCCQSPDGGKS-INIZCTEOSA-N
XLogP1.56
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide (CID 164641617) is N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide is O=C(CN1CCOC[C@@H]1CC1CCOCC1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide?
The InChIKey is JMDLCCQSPDGGKS-INIZCTEOSA-N. The full InChI is InChI=1S/C17H30N2O3/c20-17(18-15-3-1-2-4-15)12-19-7-10-22-13-16(19)11-14-5-8-21-9-6-14/h14-16H,1-13H2,(H,18,20)/t16-/m0/s1.
What are the key properties of N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide?
N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide has a molecular weight of 310.44 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(3S)-3-(oxan-4-ylmethyl)morpholin-4-yl]acetamide is sourced from PubChem (CID 164641617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).