N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide

C11H21N3O2 — CID 103977253

IUPACN-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide
SMILESCC(NC(=O)N1CCOCC1)C1CCNC1
InChIInChI=1S/C11H21N3O2/c1-9(10-2-3-12-8-10)13-11(15)14-4-6-16-7-5-14/h9-10,12H,2-8H2,1H3,(H,13,15)
InChIKeyYJIQMHQSSQQCMK-UHFFFAOYSA-N
MW227.31 g/mol
LogP0.03
Rot. Bonds2

About N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide

N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide (PubChem CID 103977253) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide
PubChem CID103977253
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide
SMILESCC(NC(=O)N1CCOCC1)C1CCNC1
InChIInChI=1S/C11H21N3O2/c1-9(10-2-3-12-8-10)13-11(15)14-4-6-16-7-5-14/h9-10,12H,2-8H2,1H3,(H,13,15)
InChIKeyYJIQMHQSSQQCMK-UHFFFAOYSA-N
XLogP0.03
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide?
The IUPAC name of N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide (CID 103977253) is N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide?
The canonical SMILES for N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide is CC(NC(=O)N1CCOCC1)C1CCNC1.
What is the InChIKey of N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide?
The InChIKey is YJIQMHQSSQQCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-9(10-2-3-12-8-10)13-11(15)14-4-6-16-7-5-14/h9-10,12H,2-8H2,1H3,(H,13,15).
What are the key properties of N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide?
N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide has a molecular weight of 227.31 g/mol, XLogP of 0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide is sourced from PubChem (CID 103977253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).