3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide

C14H29N3O2 — CID 109016748

IUPAC3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide
SMILESCCCCCNC(=O)CCNCCN1CCOCC1
InChIInChI=1S/C14H29N3O2/c1-2-3-4-6-16-14(18)5-7-15-8-9-17-10-12-19-13-11-17/h15H,2-13H2,1H3,(H,16,18)
InChIKeyFPLFJIUKEAVTFN-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.60
Rot. Bonds10

About 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide

3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide (PubChem CID 109016748) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide.

Molecular Properties

Compound Name3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide
PubChem CID109016748
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide
SMILESCCCCCNC(=O)CCNCCN1CCOCC1
InChIInChI=1S/C14H29N3O2/c1-2-3-4-6-16-14(18)5-7-15-8-9-17-10-12-19-13-11-17/h15H,2-13H2,1H3,(H,16,18)
InChIKeyFPLFJIUKEAVTFN-UHFFFAOYSA-N
XLogP0.60
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.60
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

1-(2-morpholin-4-ylethyl)-3-pentylurea
CID 108988288
N-(2-morpholin-4-ylethyl)pentanamide;sulfuric acid
CID 162122494
N-(3-morpholin-4-ylpropyl)butanamide
CID 4162480
N-ethyl-3-(3-morpholin-4-ylpropylamino)propanamide
CID 55024787
3-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109015495
1-(3-morpholin-4-ylpropanoylamino)-3-octadecylurea
CID 18968658
(Z)-N-(2-morpholin-4-ylethyl)octadec-9-enamide
CID 169211001
N-(3-morpholin-4-ylpropyl)octadecanamide;phosphoric acid
CID 172692510
N'-(3-morpholin-4-ylpropyl)-N-octadecyloxamide
CID 18968645
2,2-dimethyl-N-(2-morpholin-4-ylethyl)-N'-pentylpropanediamide
CID 108960403
3-(hexylamino)-N-tetradecylpropanamide
CID 58105395
3-(2-morpholin-4-ylethylamino)propanoic acid
CID 28830354

Frequently Asked Questions

What is the IUPAC name of 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide?
The IUPAC name of 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide (CID 109016748) is 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide.
What is the SMILES notation for 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide?
The canonical SMILES for 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide is CCCCCNC(=O)CCNCCN1CCOCC1.
What is the InChIKey of 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide?
The InChIKey is FPLFJIUKEAVTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-2-3-4-6-16-14(18)5-7-15-8-9-17-10-12-19-13-11-17/h15H,2-13H2,1H3,(H,16,18).
What are the key properties of 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide?
3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide has a molecular weight of 271.40 g/mol, XLogP of 0.60, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-morpholin-4-ylethylamino)-N-pentylpropanamide is sourced from PubChem (CID 109016748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).