N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide

C23H30N4O3 — CID 86945002

IUPACN-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
SMILESO=C(Cc1coc(-c2ccccc2)n1)NCCN1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C23H30N4O3/c28-21(16-20-17-30-22(25-20)18-6-2-1-3-7-18)24-10-11-26-12-14-27(15-13-26)23(29)19-8-4-5-9-19/h1-3,6-7,17,19H,4-5,8-16H2,(H,24,28)
InChIKeyQVKBGIPIMVZWPV-UHFFFAOYSA-N
MW410.52 g/mol
LogP2.33
Rot. Bonds7

About N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide

N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide (PubChem CID 86945002) has the molecular formula C23H30N4O3 and a molecular weight of 410.52 g/mol. Its IUPAC name is N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
PubChem CID86945002
Molecular FormulaC23H30N4O3
Molecular Weight410.52 g/mol
Exact Mass410.23
IUPAC NameN-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
SMILESO=C(Cc1coc(-c2ccccc2)n1)NCCN1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C23H30N4O3/c28-21(16-20-17-30-22(25-20)18-6-2-1-3-7-18)24-10-11-26-12-14-27(15-13-26)23(29)19-8-4-5-9-19/h1-3,6-7,17,19H,4-5,8-16H2,(H,24,28)
InChIKeyQVKBGIPIMVZWPV-UHFFFAOYSA-N
XLogP2.33
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.52
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 86944767
2-methyl-N-[2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]ethyl]propanamide
CID 39436445
N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 95159322
N-(1-benzylpiperidin-4-yl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 38548867
1-[2-(azepan-1-yl)ethyl]-2-methyl-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]guanidine
CID 111553425
2-methyl-1-[(2-phenyl-1,3-oxazol-4-yl)methyl]-3-(2-piperidin-1-ylethyl)guanidine
CID 111553621
N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-3-(2,3-dichlorophenyl)propanamide
CID 86944746
N-[(4-methylmorpholin-2-yl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 49093763
N-[2-(2-fluorophenyl)ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 39441204
1-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-3-ethyl-2-[(2-methylphenyl)methyl]guanidine
CID 111839001
N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-propan-2-ylquinoline-4-carboxamide
CID 86944885
N-[2-(tert-butylamino)-2-oxoethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34201550

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide (CID 86945002) is N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide is O=C(Cc1coc(-c2ccccc2)n1)NCCN1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The InChIKey is QVKBGIPIMVZWPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O3/c28-21(16-20-17-30-22(25-20)18-6-2-1-3-7-18)24-10-11-26-12-14-27(15-13-26)23(29)19-8-4-5-9-19/h1-3,6-7,17,19H,4-5,8-16H2,(H,24,28).
What are the key properties of N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide has a molecular weight of 410.52 g/mol, XLogP of 2.33, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 86945002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).