2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide

C10H23N3O — CID 103388840

IUPAC2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)NC(C)CN
InChIInChI=1S/C10H23N3O/c1-5-13(6-2)10(14)9(4)12-8(3)7-11/h8-9,12H,5-7,11H2,1-4H3
InChIKeyGBJABGFRHYYOAP-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.18
Rot. Bonds6

About 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide

2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide (PubChem CID 103388840) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide.

Molecular Properties

Compound Name2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide
PubChem CID103388840
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC Name2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)NC(C)CN
InChIInChI=1S/C10H23N3O/c1-5-13(6-2)10(14)9(4)12-8(3)7-11/h8-9,12H,5-7,11H2,1-4H3
InChIKeyGBJABGFRHYYOAP-UHFFFAOYSA-N
XLogP0.18
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide?
The IUPAC name of 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide (CID 103388840) is 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide.
What is the SMILES notation for 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide?
The canonical SMILES for 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide is CCN(CC)C(=O)C(C)NC(C)CN.
What is the InChIKey of 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide?
The InChIKey is GBJABGFRHYYOAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-5-13(6-2)10(14)9(4)12-8(3)7-11/h8-9,12H,5-7,11H2,1-4H3.
What are the key properties of 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide?
2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide has a molecular weight of 201.31 g/mol, XLogP of 0.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide is sourced from PubChem (CID 103388840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).