2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide

C11H22N4O3 — CID 20622313

IUPAC2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide
SMILESCNC(=O)C(C)NC(=O)C(C)NC(=O)C(C)NC
InChIInChI=1S/C11H22N4O3/c1-6(12-4)10(17)15-8(3)11(18)14-7(2)9(16)13-5/h6-8,12H,1-5H3,(H,13,16)(H,14,18)(H,15,17)
InChIKeyCZSZCKNHFQCBHD-UHFFFAOYSA-N
MW258.32 g/mol
LogP-1.65
Rot. Bonds6

About 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide

2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide (PubChem CID 20622313) has the molecular formula C11H22N4O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide.

Molecular Properties

Compound Name2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide
PubChem CID20622313
Molecular FormulaC11H22N4O3
Molecular Weight258.32 g/mol
Exact Mass258.17
IUPAC Name2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide
SMILESCNC(=O)C(C)NC(=O)C(C)NC(=O)C(C)NC
InChIInChI=1S/C11H22N4O3/c1-6(12-4)10(17)15-8(3)11(18)14-7(2)9(16)13-5/h6-8,12H,1-5H3,(H,13,16)(H,14,18)(H,15,17)
InChIKeyCZSZCKNHFQCBHD-UHFFFAOYSA-N
XLogP-1.65
TPSA99.33 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 5-1.65
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide?
The IUPAC name of 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide (CID 20622313) is 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide.
What is the SMILES notation for 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide?
The canonical SMILES for 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide is CNC(=O)C(C)NC(=O)C(C)NC(=O)C(C)NC.
What is the InChIKey of 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide?
The InChIKey is CZSZCKNHFQCBHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O3/c1-6(12-4)10(17)15-8(3)11(18)14-7(2)9(16)13-5/h6-8,12H,1-5H3,(H,13,16)(H,14,18)(H,15,17).
What are the key properties of 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide?
2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide has a molecular weight of 258.32 g/mol, XLogP of -1.65, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[1-[[1-(methylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide is sourced from PubChem (CID 20622313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).