N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride

C12H25ClN4O2 — CID 119921450

IUPACN-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
SMILESCCCN(CC(=O)NC(=O)NCC)C1CCNC1.Cl
InChIInChI=1S/C12H24N4O2.ClH/c1-3-7-16(10-5-6-13-8-10)9-11(17)15-12(18)14-4-2;/h10,13H,3-9H2,1-2H3,(H2,14,15,17,18);1H
InChIKeyJIXZSQYOXMWLRV-UHFFFAOYSA-N
MW292.81 g/mol
LogP0.33
Rot. Bonds6

About N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride

N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride (PubChem CID 119921450) has the molecular formula C12H25ClN4O2 and a molecular weight of 292.81 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
PubChem CID119921450
Molecular FormulaC12H25ClN4O2
Molecular Weight292.81 g/mol
Exact Mass292.17
IUPAC NameN-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
SMILESCCCN(CC(=O)NC(=O)NCC)C1CCNC1.Cl
InChIInChI=1S/C12H24N4O2.ClH/c1-3-7-16(10-5-6-13-8-10)9-11(17)15-12(18)14-4-2;/h10,13H,3-9H2,1-2H3,(H2,14,15,17,18);1H
InChIKeyJIXZSQYOXMWLRV-UHFFFAOYSA-N
XLogP0.33
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride?
The IUPAC name of N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride (CID 119921450) is N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride?
The canonical SMILES for N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride is CCCN(CC(=O)NC(=O)NCC)C1CCNC1.Cl.
What is the InChIKey of N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride?
The InChIKey is JIXZSQYOXMWLRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2.ClH/c1-3-7-16(10-5-6-13-8-10)9-11(17)15-12(18)14-4-2;/h10,13H,3-9H2,1-2H3,(H2,14,15,17,18);1H.
What are the key properties of N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride?
N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride has a molecular weight of 292.81 g/mol, XLogP of 0.33, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride is sourced from PubChem (CID 119921450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).