N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide

C19H28N4O2 — CID 134127928

IUPACN-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide
SMILESCC(C1CC(c2ccccc2)NN1)N(C)C(=O)CCN1CCCC1=O
InChIInChI=1S/C19H28N4O2/c1-14(16-13-17(21-20-16)15-7-4-3-5-8-15)22(2)18(24)10-12-23-11-6-9-19(23)25/h3-5,7-8,14,16-17,20-21H,6,9-13H2,1-2H3
InChIKeyPKHOUESGVWSTDN-UHFFFAOYSA-N
MW344.46 g/mol
LogP1.45
Rot. Bonds6

About N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide

N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide (PubChem CID 134127928) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide.

Molecular Properties

Compound NameN-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide
PubChem CID134127928
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC NameN-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide
SMILESCC(C1CC(c2ccccc2)NN1)N(C)C(=O)CCN1CCCC1=O
InChIInChI=1S/C19H28N4O2/c1-14(16-13-17(21-20-16)15-7-4-3-5-8-15)22(2)18(24)10-12-23-11-6-9-19(23)25/h3-5,7-8,14,16-17,20-21H,6,9-13H2,1-2H3
InChIKeyPKHOUESGVWSTDN-UHFFFAOYSA-N
XLogP1.45
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-oxoazepan-1-yl)ethyl]-5-phenylpyrazolidine-3-carboxamide
CID 52989414
1-[4-oxo-4-(3-phenylpiperazin-1-yl)butyl]pyrrolidin-2-one
CID 74251567
N-methyl-3-(2-oxopiperidin-1-yl)-N-[(1R)-1-pyrimidin-4-ylethyl]propanamide
CID 124757772
1-[3-oxo-3-[(3S)-3-propan-2-yl-3,4-dihydro-2H-quinoxalin-1-yl]propyl]pyrrolidin-2-one
CID 95971935
N-[(2R)-1-hydroxy-1,1-diphenylpropan-2-yl]-3-(2-oxopyrrolidin-1-yl)propanamide
CID 74246576
N-(2-methyl-1-phenylpropyl)-3-(2-oxoazepan-1-yl)propanamide
CID 131945632
N-[(1S,2R,3S,6S,8S)-2-hydroxy-6-(2-hydroxyethyl)-1-methyl-8-phenyl-10-oxabicyclo[4.3.1]decan-3-yl]-N-methyl-3-(2-oxopyrrolidin-1-yl)propanamide
CID 110153508
8-acetyl-1-[3-(2-oxopyrrolidin-1-yl)propanoyl]-7-phenyl-1,4,8-triazacycloundecan-5-one
CID 131898592
N-methyl-4-(2-oxopyrrolidin-1-yl)-N-[(1S)-1-pyrimidin-4-ylethyl]butanamide
CID 124754851
N-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)-N-[(5-phenylpyrazolidin-3-yl)methyl]acetamide
CID 133117616
N-methyl-2-(2-oxoazocan-1-yl)-N-(4-phenylcyclohexyl)acetamide
CID 55761544
ethyl (2S)-2-[methyl-[2-(2-oxopyrrolidin-1-yl)ethyl]amino]propanoate
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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide?
The IUPAC name of N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide (CID 134127928) is N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide.
What is the SMILES notation for N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide?
The canonical SMILES for N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide is CC(C1CC(c2ccccc2)NN1)N(C)C(=O)CCN1CCCC1=O.
What is the InChIKey of N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide?
The InChIKey is PKHOUESGVWSTDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-14(16-13-17(21-20-16)15-7-4-3-5-8-15)22(2)18(24)10-12-23-11-6-9-19(23)25/h3-5,7-8,14,16-17,20-21H,6,9-13H2,1-2H3.
What are the key properties of N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide?
N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide has a molecular weight of 344.46 g/mol, XLogP of 1.45, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-oxopyrrolidin-1-yl)-N-[1-(5-phenylpyrazolidin-3-yl)ethyl]propanamide is sourced from PubChem (CID 134127928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).