N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide

C12H22N2O3 — CID 110268322

IUPACN,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide
SMILESCNC(=O)C1(C)CN(C2CCOCC2)CCO1
InChIInChI=1S/C12H22N2O3/c1-12(11(15)13-2)9-14(5-8-17-12)10-3-6-16-7-4-10/h10H,3-9H2,1-2H3,(H,13,15)
InChIKeyRUPTZFHFYSMQDX-UHFFFAOYSA-N
MW242.32 g/mol
LogP0.00
Rot. Bonds2

About N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide

N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide (PubChem CID 110268322) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide
PubChem CID110268322
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC NameN,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide
SMILESCNC(=O)C1(C)CN(C2CCOCC2)CCO1
InChIInChI=1S/C12H22N2O3/c1-12(11(15)13-2)9-14(5-8-17-12)10-3-6-16-7-4-10/h10H,3-9H2,1-2H3,(H,13,15)
InChIKeyRUPTZFHFYSMQDX-UHFFFAOYSA-N
XLogP0.00
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide?
The IUPAC name of N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide (CID 110268322) is N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide.
What is the SMILES notation for N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide?
The canonical SMILES for N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide is CNC(=O)C1(C)CN(C2CCOCC2)CCO1.
What is the InChIKey of N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide?
The InChIKey is RUPTZFHFYSMQDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-12(11(15)13-2)9-14(5-8-17-12)10-3-6-16-7-4-10/h10H,3-9H2,1-2H3,(H,13,15).
What are the key properties of N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide?
N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide has a molecular weight of 242.32 g/mol, XLogP of 0.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-4-(oxan-4-yl)morpholine-2-carboxamide is sourced from PubChem (CID 110268322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).