N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride

C8H18ClN3O2 — CID 155822143

IUPACN-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride
SMILESCNCC(=O)N(C)CCC(=O)NC.Cl
InChIInChI=1S/C8H17N3O2.ClH/c1-9-6-8(13)11(3)5-4-7(12)10-2;/h9H,4-6H2,1-3H3,(H,10,12);1H
InChIKeyMHTLIPCZTREOHV-UHFFFAOYSA-N
MW223.70 g/mol
LogP-0.78
Rot. Bonds5

About N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride

N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride (PubChem CID 155822143) has the molecular formula C8H18ClN3O2 and a molecular weight of 223.70 g/mol. Its IUPAC name is N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride
PubChem CID155822143
Molecular FormulaC8H18ClN3O2
Molecular Weight223.70 g/mol
Exact Mass223.11
IUPAC NameN-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride
SMILESCNCC(=O)N(C)CCC(=O)NC.Cl
InChIInChI=1S/C8H17N3O2.ClH/c1-9-6-8(13)11(3)5-4-7(12)10-2;/h9H,4-6H2,1-3H3,(H,10,12);1H
InChIKeyMHTLIPCZTREOHV-UHFFFAOYSA-N
XLogP-0.78
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.70
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride?
The IUPAC name of N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride (CID 155822143) is N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride.
What is the SMILES notation for N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride?
The canonical SMILES for N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride is CNCC(=O)N(C)CCC(=O)NC.Cl.
What is the InChIKey of N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride?
The InChIKey is MHTLIPCZTREOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2.ClH/c1-9-6-8(13)11(3)5-4-7(12)10-2;/h9H,4-6H2,1-3H3,(H,10,12);1H.
What are the key properties of N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride?
N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride has a molecular weight of 223.70 g/mol, XLogP of -0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[methyl-[2-(methylamino)acetyl]amino]propanamide;hydrochloride is sourced from PubChem (CID 155822143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).