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

C8H18ClN3O2 — CID 155858459

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

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

N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride (PubChem CID 155858459) has the molecular formula C8H18ClN3O2 and a molecular weight of 223.70 g/mol. Its IUPAC name is N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride
PubChem CID155858459
Molecular FormulaC8H18ClN3O2
Molecular Weight223.70 g/mol
Exact Mass223.11
IUPAC NameN-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride
SMILESCNCCC(=O)N(C)CC(=O)NC.Cl
InChIInChI=1S/C8H17N3O2.ClH/c1-9-5-4-8(13)11(3)6-7(12)10-2;/h9H,4-6H2,1-3H3,(H,10,12);1H
InChIKeyDYJBZTGWQGUGAM-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-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride?
The IUPAC name of N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride (CID 155858459) is N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride.
What is the SMILES notation for N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride?
The canonical SMILES for N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride is CNCCC(=O)N(C)CC(=O)NC.Cl.
What is the InChIKey of N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride?
The InChIKey is DYJBZTGWQGUGAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2.ClH/c1-9-5-4-8(13)11(3)6-7(12)10-2;/h9H,4-6H2,1-3H3,(H,10,12);1H.
What are the key properties of N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride?
N-methyl-3-(methylamino)-N-[2-(methylamino)-2-oxoethyl]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-(methylamino)-N-[2-(methylamino)-2-oxoethyl]propanamide;hydrochloride is sourced from PubChem (CID 155858459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).