(3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide

C10H20N4O3 — CID 43348307

IUPAC(3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide
SMILESN/C(CC(=O)NCCCN1CCOCC1)=N\O
InChIInChI=1S/C10H20N4O3/c11-9(13-16)8-10(15)12-2-1-3-14-4-6-17-7-5-14/h16H,1-8H2,(H2,11,13)(H,12,15)
InChIKeySHHBMFDICHFZLC-UHFFFAOYSA-N
MW244.29 g/mol
LogP-1.04
Rot. Bonds6

About (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide

(3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide (PubChem CID 43348307) has the molecular formula C10H20N4O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide.

Molecular Properties

Compound Name(3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide
PubChem CID43348307
Molecular FormulaC10H20N4O3
Molecular Weight244.29 g/mol
Exact Mass244.15
IUPAC Name(3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide
SMILESN/C(CC(=O)NCCCN1CCOCC1)=N\O
InChIInChI=1S/C10H20N4O3/c11-9(13-16)8-10(15)12-2-1-3-14-4-6-17-7-5-14/h16H,1-8H2,(H2,11,13)(H,12,15)
InChIKeySHHBMFDICHFZLC-UHFFFAOYSA-N
XLogP-1.04
TPSA100.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-1.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-hydroxy-3-(morpholin-4-yl)-3-oxopropanimidamide
CID 16775542
(2E)-2-(hydroxyimino)-N-[3-(morpholin-4-yl)propyl]propanamide
CID 9595054
3,3,3-trifluoro-N'-hydroxy-2-[[(3-morpholin-4-yl-3-oxopropyl)amino]methyl]propanimidamide
CID 103370147
(3Z)-3-amino-3-hydroxyimino-N-(2-methoxyethyl)propanamide
CID 16773729
3-Morpholin-4-yl-3-oxopropanimidamide
CID 59789766
(2Z)-2-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide
CID 6410306
(2Z)-2-hydroxyimino-N-[3-(4-methylmorpholin-4-ium-4-yl)propyl]propanamide
CID 6411092
2-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide
CID 6809448
2-hydroxyimino-N-[3-(4-methylmorpholin-4-ium-4-yl)propyl]propanamide
CID 6821865
(2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide
CID 7269550
4-(3-{[(2E)-2-(hydroxyimino)propanoyl]amino}propyl)-4-methylmorpholin-4-ium
CID 9595056
N-butyl-3-cyanoimino-3-morpholin-4-ylpropanamide
CID 12502631

Frequently Asked Questions

What is the IUPAC name of (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide?
The IUPAC name of (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide (CID 43348307) is (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide.
What is the SMILES notation for (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide?
The canonical SMILES for (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide is N/C(CC(=O)NCCCN1CCOCC1)=N\O.
What is the InChIKey of (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide?
The InChIKey is SHHBMFDICHFZLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O3/c11-9(13-16)8-10(15)12-2-1-3-14-4-6-17-7-5-14/h16H,1-8H2,(H2,11,13)(H,12,15).
What are the key properties of (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide?
(3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide has a molecular weight of 244.29 g/mol, XLogP of -1.04, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-amino-3-hydroxyimino-N-(3-morpholin-4-ylpropyl)propanamide is sourced from PubChem (CID 43348307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).