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

C9H19N3O2 — CID 155070806

IUPACN-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide
SMILESCCC(=O)NC(C)CNC(=O)CNC
InChIInChI=1S/C9H19N3O2/c1-4-8(13)12-7(2)5-11-9(14)6-10-3/h7,10H,4-6H2,1-3H3,(H,11,14)(H,12,13)
InChIKeyJWPUOQQEACFXJR-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.76
Rot. Bonds6

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

N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide (PubChem CID 155070806) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide.

Molecular Properties

Compound NameN-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide
PubChem CID155070806
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC NameN-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide
SMILESCCC(=O)NC(C)CNC(=O)CNC
InChIInChI=1S/C9H19N3O2/c1-4-8(13)12-7(2)5-11-9(14)6-10-3/h7,10H,4-6H2,1-3H3,(H,11,14)(H,12,13)
InChIKeyJWPUOQQEACFXJR-UHFFFAOYSA-N
XLogP-0.76
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(propanoylamino)propyl]propanamide
CID 3569677
ethyl N-[2-(propanoylamino)propyl]carbamodithioate
CID 59072300
2-(methylamino)-N-(1-piperidin-1-ylpropan-2-yl)acetamide
CID 43695360
N-ethyl-2-(methylamino)acetamide;hydrochloride
CID 18526161
2-(methylamino)-N-[2-oxo-2-(2-oxobutylamino)ethyl]acetamide
CID 175620098
methyl 3-[2-[(3-methoxy-3-oxopropanoyl)amino]propylamino]-3-oxopropanoate
CID 10378628
N-[2-(dimethylamino)-4-methylpentyl]-2-(methylamino)acetamide
CID 61275240
(2R)-2-[[2-[[2-[[2-[[2-[[2-(methylamino)acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]propanoic acid
CID 171100444
N-[2-(2-hydroxyethyl)pentyl]-2-(methylamino)acetamide;hydrochloride
CID 120704813
N-(2-bromopropyl)propanamide
CID 87559070
2-(methylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide
CID 61276217
(2S)-2-amino-N-[(2S)-1-(propanoylamino)propan-2-yl]propanamide;N-[(2S)-2-aminopropyl]propanamide;ethane;methanol
CID 159551322

Frequently Asked Questions

What is the IUPAC name of N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide?
The IUPAC name of N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide (CID 155070806) is N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide.
What is the SMILES notation for N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide?
The canonical SMILES for N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide is CCC(=O)NC(C)CNC(=O)CNC.
What is the InChIKey of N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide?
The InChIKey is JWPUOQQEACFXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-4-8(13)12-7(2)5-11-9(14)6-10-3/h7,10H,4-6H2,1-3H3,(H,11,14)(H,12,13).
What are the key properties of N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide?
N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide has a molecular weight of 201.27 g/mol, XLogP of -0.76, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[[2-(methylamino)acetyl]amino]propan-2-yl]propanamide is sourced from PubChem (CID 155070806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).