N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide

C8H17FN2O3 — CID 166168910

IUPACN-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide
SMILESNCC(F)COCCCNC(=O)CO
InChIInChI=1S/C8H17FN2O3/c9-7(4-10)6-14-3-1-2-11-8(13)5-12/h7,12H,1-6,10H2,(H,11,13)
InChIKeyNYDJVQKZYRSBGB-UHFFFAOYSA-N
MW208.23 g/mol
LogP-1.20
Rot. Bonds8

About N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide

N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide (PubChem CID 166168910) has the molecular formula C8H17FN2O3 and a molecular weight of 208.23 g/mol. Its IUPAC name is N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide.

Molecular Properties

Compound NameN-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide
PubChem CID166168910
Molecular FormulaC8H17FN2O3
Molecular Weight208.23 g/mol
Exact Mass208.12
IUPAC NameN-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide
SMILESNCC(F)COCCCNC(=O)CO
InChIInChI=1S/C8H17FN2O3/c9-7(4-10)6-14-3-1-2-11-8(13)5-12/h7,12H,1-6,10H2,(H,11,13)
InChIKeyNYDJVQKZYRSBGB-UHFFFAOYSA-N
XLogP-1.20
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.23
LogP ≤ 5-1.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-fluoro-3-[2-[2-[2-[2-[2-[(2-hydroxyacetyl)amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2-methylpropanamide;yttrium
CID 155739438
3-butoxy-2-fluoropropan-1-amine
CID 155690317
2-hydroxy-N-[3-[(2-hydroxyacetyl)amino]propyl]acetamide
CID 142043672
N-[2-(4-aminobutoxy)ethyl]-2-hydroxyacetamide;ethane
CID 176551845
N-(5-aminopentyl)-3-(2,2-difluoroethoxy)propanamide
CID 103205484
2-hydroxy-N-[7-[(2-hydroxyacetyl)amino]heptyl]acetamide
CID 119089107
5-amino-N-[3-(2-hydroxyethoxy)propyl]-4-methylpentanamide
CID 106310722
N-[3-(3-amino-2,2-difluoropropoxy)-2-fluoropropyl]-2-hydroxyacetamide
CID 166168365
N-[3-(2-methylpropoxy)propyl]propanamide
CID 60705995
N-[2-fluoro-3-[3-[3-[(2-propan-2-yloxyacetyl)amino]propoxy]propoxy]propyl]-2-methylpropanamide
CID 155459731
2-amino-N-[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl]acetamide
CID 123586963
4-amino-N-(3-butoxypropyl)-3-methylbutanamide
CID 115737913

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide?
The IUPAC name of N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide (CID 166168910) is N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide.
What is the SMILES notation for N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide?
The canonical SMILES for N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide is NCC(F)COCCCNC(=O)CO.
What is the InChIKey of N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide?
The InChIKey is NYDJVQKZYRSBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17FN2O3/c9-7(4-10)6-14-3-1-2-11-8(13)5-12/h7,12H,1-6,10H2,(H,11,13).
What are the key properties of N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide?
N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide has a molecular weight of 208.23 g/mol, XLogP of -1.20, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-amino-2-fluoropropoxy)propyl]-2-hydroxyacetamide is sourced from PubChem (CID 166168910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).