2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide

C9H19N3O3 — CID 43573322

IUPAC2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide
SMILESCC(NC(N)=O)C(=O)N(CCO)C(C)C
InChIInChI=1S/C9H19N3O3/c1-6(2)12(4-5-13)8(14)7(3)11-9(10)15/h6-7,13H,4-5H2,1-3H3,(H3,10,11,15)
InChIKeyROJWQQXAQDVCJZ-UHFFFAOYSA-N
MW217.27 g/mol
LogP-0.73
Rot. Bonds5

About 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide

2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide (PubChem CID 43573322) has the molecular formula C9H19N3O3 and a molecular weight of 217.27 g/mol. Its IUPAC name is 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide
PubChem CID43573322
Molecular FormulaC9H19N3O3
Molecular Weight217.27 g/mol
Exact Mass217.14
IUPAC Name2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide
SMILESCC(NC(N)=O)C(=O)N(CCO)C(C)C
InChIInChI=1S/C9H19N3O3/c1-6(2)12(4-5-13)8(14)7(3)11-9(10)15/h6-7,13H,4-5H2,1-3H3,(H3,10,11,15)
InChIKeyROJWQQXAQDVCJZ-UHFFFAOYSA-N
XLogP-0.73
TPSA95.66 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 5-0.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(carbamoylamino)-N-ethyl-N-(2-hydroxyethyl)propanamide
CID 60958324
N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide
CID 43573547
2-(carbamoylamino)-N-(5-hydroxypentyl)-N-methylpropanamide
CID 107202680
2-amino-N-(2-hydroxyethyl)-4-methyl-N-propan-2-ylpentanamide
CID 43579455
3-[[2-hydroxyethyl(propan-2-yl)carbamoyl]-propan-2-ylamino]propanoic acid
CID 54994879
N-[1-[3-hydroxypropyl(propan-2-yl)amino]-1-oxopropan-2-yl]thiophene-2-carboxamide
CID 61039914
N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide
CID 119658379
(2R)-3-hydroxy-2-[[2-hydroxyethyl(propan-2-yl)carbamoyl]amino]propanoic acid
CID 80756986
N-carbamoyl-3-[2-hydroxyethyl(propan-2-yl)amino]propanamide
CID 60706598
2-[[2-hydroxyethyl(propan-2-yl)carbamoyl]amino]-3-methylbutanoic acid
CID 54995171
2-[(2-amino-2-oxoethyl)-[2-(carbamoylamino)propanoyl]amino]acetic acid
CID 107434098
N-(3-hydroxypropyl)-2-methyl-N-propan-2-ylpropanamide
CID 61040005

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide?
The IUPAC name of 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide (CID 43573322) is 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide is CC(NC(N)=O)C(=O)N(CCO)C(C)C.
What is the InChIKey of 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide?
The InChIKey is ROJWQQXAQDVCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O3/c1-6(2)12(4-5-13)8(14)7(3)11-9(10)15/h6-7,13H,4-5H2,1-3H3,(H3,10,11,15).
What are the key properties of 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide?
2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide has a molecular weight of 217.27 g/mol, XLogP of -0.73, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 43573322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).