N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide

C9H19N3O4 — CID 103605668

IUPACN-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide
SMILESCOCCOCCCNCC(=O)NC(N)=O
InChIInChI=1S/C9H19N3O4/c1-15-5-6-16-4-2-3-11-7-8(13)12-9(10)14/h11H,2-7H2,1H3,(H3,10,12,13,14)
InChIKeySRHYAPSHHHXRBA-UHFFFAOYSA-N
MW233.27 g/mol
LogP-1.18
Rot. Bonds9

About N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide

N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide (PubChem CID 103605668) has the molecular formula C9H19N3O4 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide
PubChem CID103605668
Molecular FormulaC9H19N3O4
Molecular Weight233.27 g/mol
Exact Mass233.14
IUPAC NameN-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide
SMILESCOCCOCCCNCC(=O)NC(N)=O
InChIInChI=1S/C9H19N3O4/c1-15-5-6-16-4-2-3-11-7-8(13)12-9(10)14/h11H,2-7H2,1H3,(H3,10,12,13,14)
InChIKeySRHYAPSHHHXRBA-UHFFFAOYSA-N
XLogP-1.18
TPSA102.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 5-1.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide?
The IUPAC name of N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide (CID 103605668) is N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide.
What is the SMILES notation for N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide?
The canonical SMILES for N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide is COCCOCCCNCC(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide?
The InChIKey is SRHYAPSHHHXRBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O4/c1-15-5-6-16-4-2-3-11-7-8(13)12-9(10)14/h11H,2-7H2,1H3,(H3,10,12,13,14).
What are the key properties of N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide?
N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide has a molecular weight of 233.27 g/mol, XLogP of -1.18, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[3-(2-methoxyethoxy)propylamino]acetamide is sourced from PubChem (CID 103605668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).