2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide

C13H27N3O2 — CID 60687135

IUPAC2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CNCCN1CCOCC1
InChIInChI=1S/C13H27N3O2/c1-3-4-12(2)15-13(17)11-14-5-6-16-7-9-18-10-8-16/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyAXIBDDVJBHSSSV-UHFFFAOYSA-N
MW257.38 g/mol
LogP0.21
Rot. Bonds8

About 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide

2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide (PubChem CID 60687135) has the molecular formula C13H27N3O2 and a molecular weight of 257.38 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide
PubChem CID60687135
Molecular FormulaC13H27N3O2
Molecular Weight257.38 g/mol
Exact Mass257.21
IUPAC Name2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CNCCN1CCOCC1
InChIInChI=1S/C13H27N3O2/c1-3-4-12(2)15-13(17)11-14-5-6-16-7-9-18-10-8-16/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyAXIBDDVJBHSSSV-UHFFFAOYSA-N
XLogP0.21
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-methylbutan-2-yl)-2-(2-morpholin-4-ylethylamino)acetamide
CID 60687185
2-(2-morpholin-4-ylethylamino)acetic acid
CID 28897547
2-[(4-hydroxyoxan-4-yl)methylamino]-N-pentan-2-ylacetamide
CID 81130965
ethyl 4-[2-(2-morpholin-4-ylethylamino)acetyl]piperazine-1-carboxylate
CID 108994784
2-(3-hydroxybutylamino)-N-pentan-2-ylacetamide
CID 64911612
2-[1-(oxan-4-yl)ethylamino]-N-pentan-2-ylacetamide
CID 103914830
N-butyl-N-methyl-2-(2-morpholin-4-ylethylamino)acetamide
CID 108994800
N,N-diethyl-3-[[2-oxo-2-(pentan-2-ylamino)ethyl]amino]propanamide
CID 112685329
4-hydroxy-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 79201323
N-pentan-2-yl-2-[(1-propylpiperidin-4-yl)amino]acetamide
CID 60695886
1-(2-morpholin-4-ylethylamino)propan-2-ol
CID 43393555
N-(4-hydroxybutan-2-yl)-2-morpholin-4-ylacetamide
CID 110011691

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide?
The IUPAC name of 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide (CID 60687135) is 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide?
The canonical SMILES for 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide is CCCC(C)NC(=O)CNCCN1CCOCC1.
What is the InChIKey of 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide?
The InChIKey is AXIBDDVJBHSSSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2/c1-3-4-12(2)15-13(17)11-14-5-6-16-7-9-18-10-8-16/h12,14H,3-11H2,1-2H3,(H,15,17).
What are the key properties of 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide?
2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide has a molecular weight of 257.38 g/mol, XLogP of 0.21, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylethylamino)-N-pentan-2-ylacetamide is sourced from PubChem (CID 60687135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).