2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide

C13H24N4O2 — CID 119894915

IUPAC2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide
SMILESCC(C)(C(N)=O)N1CCN(C(=O)C2CCCN2)CC1
InChIInChI=1S/C13H24N4O2/c1-13(2,12(14)19)17-8-6-16(7-9-17)11(18)10-4-3-5-15-10/h10,15H,3-9H2,1-2H3,(H2,14,19)
InChIKeyYZVYNYRCIQWPDH-UHFFFAOYSA-N
MW268.36 g/mol
LogP-0.85
Rot. Bonds3

About 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide

2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide (PubChem CID 119894915) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound Name2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide
PubChem CID119894915
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC Name2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide
SMILESCC(C)(C(N)=O)N1CCN(C(=O)C2CCCN2)CC1
InChIInChI=1S/C13H24N4O2/c1-13(2,12(14)19)17-8-6-16(7-9-17)11(18)10-4-3-5-15-10/h10,15H,3-9H2,1-2H3,(H2,14,19)
InChIKeyYZVYNYRCIQWPDH-UHFFFAOYSA-N
XLogP-0.85
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(4-tert-butylpiperazin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 103814108
(4-tert-butylpiperazin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 61430596
(4-methylpiperazin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone;dihydrochloride
CID 165429624
pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
CID 550904
1-[4-[(2S)-pyrrolidine-2-carbonyl]-1,4-diazepan-1-yl]ethanone
CID 55002826
(4-tert-butylpiperidin-1-yl)-pyrrolidin-2-ylmethanone;hydrochloride
CID 119311371
1-[(2S)-pyrrolidine-2-carbonyl]piperidine-4-carboxamide
CID 7175999
1-[4-(pyrrolidine-2-carbonyl)-1,4-diazepan-1-yl]ethanone;hydrochloride
CID 119112195
(4-aminopiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 131224010
(4-aminopiperidin-1-yl)-pyrrolidin-2-ylmethanone
CID 110461351
cyclopropyl-[4-[(2S)-pyrrolidine-2-carbonyl]piperazin-1-yl]methanone;hydrochloride
CID 71888790
3-hydroxy-3-methyl-1-[4-[(2S)-pyrrolidine-2-carbonyl]piperazin-1-yl]butan-1-one;hydrochloride
CID 166085462

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide?
The IUPAC name of 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide (CID 119894915) is 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide.
What is the SMILES notation for 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide?
The canonical SMILES for 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide is CC(C)(C(N)=O)N1CCN(C(=O)C2CCCN2)CC1.
What is the InChIKey of 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide?
The InChIKey is YZVYNYRCIQWPDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c1-13(2,12(14)19)17-8-6-16(7-9-17)11(18)10-4-3-5-15-10/h10,15H,3-9H2,1-2H3,(H2,14,19).
What are the key properties of 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide?
2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide has a molecular weight of 268.36 g/mol, XLogP of -0.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 119894915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).