2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide

C23H44N6O5 — CID 54397390

IUPAC2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide
SMILESCNC(C)C(=O)NC(C)C(=O)N(C)C(C)C(=O)NC(C)C(=O)N(C)C(C)C(=O)NC(C)C(C)C
InChIInChI=1S/C23H44N6O5/c1-12(2)13(3)25-20(31)17(7)28(10)23(34)16(6)27-21(32)18(8)29(11)22(33)15(5)26-19(30)14(4)24-9/h12-18,24H,1-11H3,(H,25,31)(H,26,30)(H,27,32)
InChIKeyVKYQFMVAXWLSLD-UHFFFAOYSA-N
MW484.64 g/mol
LogP-0.54
Rot. Bonds12

About 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide

2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide (PubChem CID 54397390) has the molecular formula C23H44N6O5 and a molecular weight of 484.64 g/mol. Its IUPAC name is 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide.

Molecular Properties

Compound Name2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide
PubChem CID54397390
Molecular FormulaC23H44N6O5
Molecular Weight484.64 g/mol
Exact Mass484.34
IUPAC Name2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide
SMILESCNC(C)C(=O)NC(C)C(=O)N(C)C(C)C(=O)NC(C)C(=O)N(C)C(C)C(=O)NC(C)C(C)C
InChIInChI=1S/C23H44N6O5/c1-12(2)13(3)25-20(31)17(7)28(10)23(34)16(6)27-21(32)18(8)29(11)22(33)15(5)26-19(30)14(4)24-9/h12-18,24H,1-11H3,(H,25,31)(H,26,30)(H,27,32)
InChIKeyVKYQFMVAXWLSLD-UHFFFAOYSA-N
XLogP-0.54
TPSA139.95 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.64
LogP ≤ 5-0.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide?
The IUPAC name of 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide (CID 54397390) is 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide.
What is the SMILES notation for 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide?
The canonical SMILES for 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide is CNC(C)C(=O)NC(C)C(=O)N(C)C(C)C(=O)NC(C)C(=O)N(C)C(C)C(=O)NC(C)C(C)C.
What is the InChIKey of 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide?
The InChIKey is VKYQFMVAXWLSLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H44N6O5/c1-12(2)13(3)25-20(31)17(7)28(10)23(34)16(6)27-21(32)18(8)29(11)22(33)15(5)26-19(30)14(4)24-9/h12-18,24H,1-11H3,(H,25,31)(H,26,30)(H,27,32).
What are the key properties of 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide?
2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide has a molecular weight of 484.64 g/mol, XLogP of -0.54, 12 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[1-[methyl-[1-[[1-[methyl-[1-(3-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]propanamide is sourced from PubChem (CID 54397390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).