N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide

C20H29N5O3 — CID 32528500

IUPACN-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide
SMILESCCCn1c(=O)n(CC(=O)NC2CCN(CC(=O)NC)CC2)c2ccccc21
InChIInChI=1S/C20H29N5O3/c1-3-10-24-16-6-4-5-7-17(16)25(20(24)28)14-19(27)22-15-8-11-23(12-9-15)13-18(26)21-2/h4-7,15H,3,8-14H2,1-2H3,(H,21,26)(H,22,27)
InChIKeyOEKOZYDPMGFDBB-UHFFFAOYSA-N
MW387.48 g/mol
LogP0.54
Rot. Bonds7

About N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide

N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide (PubChem CID 32528500) has the molecular formula C20H29N5O3 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide
PubChem CID32528500
Molecular FormulaC20H29N5O3
Molecular Weight387.48 g/mol
Exact Mass387.23
IUPAC NameN-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide
SMILESCCCn1c(=O)n(CC(=O)NC2CCN(CC(=O)NC)CC2)c2ccccc21
InChIInChI=1S/C20H29N5O3/c1-3-10-24-16-6-4-5-7-17(16)25(20(24)28)14-19(27)22-15-8-11-23(12-9-15)13-18(26)21-2/h4-7,15H,3,8-14H2,1-2H3,(H,21,26)(H,22,27)
InChIKeyOEKOZYDPMGFDBB-UHFFFAOYSA-N
XLogP0.54
TPSA88.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-methylsulfonylpiperidin-4-yl)-2-(2-oxo-3-propylbenzimidazol-1-yl)acetamide
CID 39999738
2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 47035376
2-[4-[[2-(3-ethyl-2-oxobenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide
CID 134047876
2-[4-[[2-(3-methyl-2-oxobenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]-N-phenylacetamide
CID 24629861
N-cyclopropyl-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 17445359
N-(1-benzylpiperidin-4-yl)-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 34363205
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(4-methylcyclohexyl)acetamide
CID 18121435
2-(2-oxo-3-propylbenzimidazol-1-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 37032041
N-(1-benzylpyrrolidin-3-yl)-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 18156454
N-[1-(2-ethylbutanoyl)piperidin-4-yl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 55950899
1-[3-[4-(methylamino)piperidin-1-yl]-3-oxopropyl]-3-propylbenzimidazol-2-one
CID 119560953
N'-[3-(2-oxo-3-propylbenzimidazol-1-yl)propanoyl]cyclopropanecarbohydrazide
CID 27019386

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide?
The IUPAC name of N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide (CID 32528500) is N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide.
What is the SMILES notation for N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide?
The canonical SMILES for N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide is CCCn1c(=O)n(CC(=O)NC2CCN(CC(=O)NC)CC2)c2ccccc21.
What is the InChIKey of N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide?
The InChIKey is OEKOZYDPMGFDBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N5O3/c1-3-10-24-16-6-4-5-7-17(16)25(20(24)28)14-19(27)22-15-8-11-23(12-9-15)13-18(26)21-2/h4-7,15H,3,8-14H2,1-2H3,(H,21,26)(H,22,27).
What are the key properties of N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide?
N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide has a molecular weight of 387.48 g/mol, XLogP of 0.54, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-[[2-(2-oxo-3-propylbenzimidazol-1-yl)acetyl]amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 32528500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).