N-propyl-2-(propylcarbamoylamino)acetamide

C9H19N3O2 — CID 115571904

IUPACN-propyl-2-(propylcarbamoylamino)acetamide
SMILESCCCNC(=O)CNC(=O)NCCC
InChIInChI=1S/C9H19N3O2/c1-3-5-10-8(13)7-12-9(14)11-6-4-2/h3-7H2,1-2H3,(H,10,13)(H2,11,12,14)
InChIKeySPQFXOSKBLHYSJ-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.22
Rot. Bonds6

About N-propyl-2-(propylcarbamoylamino)acetamide

N-propyl-2-(propylcarbamoylamino)acetamide (PubChem CID 115571904) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-propyl-2-(propylcarbamoylamino)acetamide.

Molecular Properties

Compound NameN-propyl-2-(propylcarbamoylamino)acetamide
PubChem CID115571904
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC NameN-propyl-2-(propylcarbamoylamino)acetamide
SMILESCCCNC(=O)CNC(=O)NCCC
InChIInChI=1S/C9H19N3O2/c1-3-5-10-8(13)7-12-9(14)11-6-4-2/h3-7H2,1-2H3,(H,10,13)(H2,11,12,14)
InChIKeySPQFXOSKBLHYSJ-UHFFFAOYSA-N
XLogP0.22
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[2-(ethylamino)-2-oxoethyl]carbamoylamino]-N-propylpropanamide
CID 87037238
7-[[2-oxo-2-(propylamino)ethyl]carbamoylamino]heptanoic acid
CID 61202867
2-methyl-3-[[2-oxo-2-(propylamino)ethyl]carbamoylamino]propanoic acid
CID 62669389
4,4-dimethyl-6-[[2-oxo-2-(propylamino)ethyl]carbamoylamino]hexanoic acid
CID 65290131
N-cyclopropyl-2-(propylcarbamoylamino)acetamide
CID 84514772
2-[[2-oxo-2-(propylamino)ethyl]carbamoylamino]propanoic acid
CID 61201929
2-methyl-2-[[2-oxo-2-(propylamino)ethyl]carbamoylamino]propanoic acid
CID 61267137
1-(3,3-dimethyl-2-oxobutyl)-3-propylurea
CID 60733420
2-(butylcarbamoylamino)-N-(2-methoxyethyl)acetamide
CID 115574241
3-chloro-2-methyl-N-[2-oxo-2-(propylamino)ethyl]propanamide
CID 62729229
3-(tert-butylamino)-N-[2-oxo-2-(propylamino)ethyl]propanamide
CID 60850956
2-(diethylcarbamoylamino)-N-propylacetamide
CID 115575868

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-(propylcarbamoylamino)acetamide?
The IUPAC name of N-propyl-2-(propylcarbamoylamino)acetamide (CID 115571904) is N-propyl-2-(propylcarbamoylamino)acetamide.
What is the SMILES notation for N-propyl-2-(propylcarbamoylamino)acetamide?
The canonical SMILES for N-propyl-2-(propylcarbamoylamino)acetamide is CCCNC(=O)CNC(=O)NCCC.
What is the InChIKey of N-propyl-2-(propylcarbamoylamino)acetamide?
The InChIKey is SPQFXOSKBLHYSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-3-5-10-8(13)7-12-9(14)11-6-4-2/h3-7H2,1-2H3,(H,10,13)(H2,11,12,14).
What are the key properties of N-propyl-2-(propylcarbamoylamino)acetamide?
N-propyl-2-(propylcarbamoylamino)acetamide has a molecular weight of 201.27 g/mol, XLogP of 0.22, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-(propylcarbamoylamino)acetamide is sourced from PubChem (CID 115571904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).