2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide

C8H17N3O3 — CID 60958324

IUPAC2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide
SMILESCCN(CCO)C(=O)C(C)NC(N)=O
InChIInChI=1S/C8H17N3O3/c1-3-11(4-5-12)7(13)6(2)10-8(9)14/h6,12H,3-5H2,1-2H3,(H3,9,10,14)
InChIKeyNTVZTRMJOPBHEO-UHFFFAOYSA-N
MW203.24 g/mol
LogP-1.12
Rot. Bonds5

About 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide

2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide (PubChem CID 60958324) has the molecular formula C8H17N3O3 and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide.

Molecular Properties

Compound Name2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide
PubChem CID60958324
Molecular FormulaC8H17N3O3
Molecular Weight203.24 g/mol
Exact Mass203.13
IUPAC Name2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide
SMILESCCN(CCO)C(=O)C(C)NC(N)=O
InChIInChI=1S/C8H17N3O3/c1-3-11(4-5-12)7(13)6(2)10-8(9)14/h6,12H,3-5H2,1-2H3,(H3,9,10,14)
InChIKeyNTVZTRMJOPBHEO-UHFFFAOYSA-N
XLogP-1.12
TPSA95.66 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 5-1.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide?
The IUPAC name of 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide (CID 60958324) is 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide.
What is the SMILES notation for 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide?
The canonical SMILES for 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide is CCN(CCO)C(=O)C(C)NC(N)=O.
What is the InChIKey of 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide?
The InChIKey is NTVZTRMJOPBHEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3/c1-3-11(4-5-12)7(13)6(2)10-8(9)14/h6,12H,3-5H2,1-2H3,(H3,9,10,14).
What are the key properties of 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide?
2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide has a molecular weight of 203.24 g/mol, XLogP of -1.12, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide is sourced from PubChem (CID 60958324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).