2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide

C11H23N3O3 — CID 81081646

IUPAC2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide
SMILESCOCC(N)C(=O)NCCCN1CCOCC1
InChIInChI=1S/C11H23N3O3/c1-16-9-10(12)11(15)13-3-2-4-14-5-7-17-8-6-14/h10H,2-9,12H2,1H3,(H,13,15)
InChIKeyJDTVWIFWGUTMSU-UHFFFAOYSA-N
MW245.32 g/mol
LogP-1.20
Rot. Bonds7

About 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide

2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide (PubChem CID 81081646) has the molecular formula C11H23N3O3 and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide.

Molecular Properties

Compound Name2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide
PubChem CID81081646
Molecular FormulaC11H23N3O3
Molecular Weight245.32 g/mol
Exact Mass245.17
IUPAC Name2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide
SMILESCOCC(N)C(=O)NCCCN1CCOCC1
InChIInChI=1S/C11H23N3O3/c1-16-9-10(12)11(15)13-3-2-4-14-5-7-17-8-6-14/h10H,2-9,12H2,1H3,(H,13,15)
InChIKeyJDTVWIFWGUTMSU-UHFFFAOYSA-N
XLogP-1.20
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 5-1.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-amino-4-methyl-N-(3-morpholin-4-ylpropyl)pentanamide;dihydrochloride
CID 119827262
(2S)-2-amino-4-methyl-N-(3-morpholin-4-ylpropyl)pentanamide
CID 61148304
(2S)-2-amino-N-(3-morpholin-4-ylpropyl)hexanamide
CID 93339966
(2S)-2-amino-3,3-dimethyl-N-(4-morpholin-4-ylbutyl)butanamide;dihydrochloride
CID 119852486
2-(2-methoxyethoxy)-N-(3-morpholin-4-ylpropyl)acetamide
CID 103606858
2-(2-methoxyethylamino)-N-(4-morpholin-4-ylbutyl)acetamide;dihydrochloride
CID 119852507
2-amino-N-(2-morpholin-4-ylethyl)propanamide;dihydrochloride
CID 119827782
2-amino-2-(4-methylphenyl)-N-(3-morpholin-4-ylpropyl)acetamide;dihydrochloride
CID 120669272
1-(3-methoxypropyl)-3-(3-morpholin-4-ylpropyl)thiourea
CID 115570403
hexadecyl N-(3-morpholin-4-ylpropyl)carbamate
CID 18968646
N,N'-bis(3-morpholin-4-ylpropyl)propanediamide
CID 21205309
2-[[amino-(3-morpholin-4-ylpropylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide
CID 111037016

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide?
The IUPAC name of 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide (CID 81081646) is 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide.
What is the SMILES notation for 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide?
The canonical SMILES for 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide is COCC(N)C(=O)NCCCN1CCOCC1.
What is the InChIKey of 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide?
The InChIKey is JDTVWIFWGUTMSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3/c1-16-9-10(12)11(15)13-3-2-4-14-5-7-17-8-6-14/h10H,2-9,12H2,1H3,(H,13,15).
What are the key properties of 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide?
2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide has a molecular weight of 245.32 g/mol, XLogP of -1.20, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-N-(3-morpholin-4-ylpropyl)propanamide is sourced from PubChem (CID 81081646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).