N-tert-butyl-3-morpholin-4-ylpropanamide

C11H22N2O2 — CID 840496

IUPACN-tert-butyl-3-morpholin-4-ylpropanamide
SMILESCC(C)(C)NC(=O)CCN1CCOCC1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)12-10(14)4-5-13-6-8-15-9-7-13/h4-9H2,1-3H3,(H,12,14)
InChIKeyICDXALKVCXVBGV-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.62
Rot. Bonds3

About N-tert-butyl-3-morpholin-4-ylpropanamide

N-tert-butyl-3-morpholin-4-ylpropanamide (PubChem CID 840496) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-tert-butyl-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-tert-butyl-3-morpholin-4-ylpropanamide
PubChem CID840496
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-tert-butyl-3-morpholin-4-ylpropanamide
SMILESCC(C)(C)NC(=O)CCN1CCOCC1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)12-10(14)4-5-13-6-8-15-9-7-13/h4-9H2,1-3H3,(H,12,14)
InChIKeyICDXALKVCXVBGV-UHFFFAOYSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-morpholin-4-ylpropanamide?
The IUPAC name of N-tert-butyl-3-morpholin-4-ylpropanamide (CID 840496) is N-tert-butyl-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-tert-butyl-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-tert-butyl-3-morpholin-4-ylpropanamide is CC(C)(C)NC(=O)CCN1CCOCC1.
What is the InChIKey of N-tert-butyl-3-morpholin-4-ylpropanamide?
The InChIKey is ICDXALKVCXVBGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2,3)12-10(14)4-5-13-6-8-15-9-7-13/h4-9H2,1-3H3,(H,12,14).
What are the key properties of N-tert-butyl-3-morpholin-4-ylpropanamide?
N-tert-butyl-3-morpholin-4-ylpropanamide has a molecular weight of 214.31 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 840496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).