N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide

C21H30FN3O3 — CID 3434054

IUPACN-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide
SMILESCC(C)CN(CC(=O)N1CC(=O)N(c2ccc(F)cc2)C1)C(=O)CC(C)(C)C
InChIInChI=1S/C21H30FN3O3/c1-15(2)11-23(18(26)10-21(3,4)5)12-19(27)24-13-20(28)25(14-24)17-8-6-16(22)7-9-17/h6-9,15H,10-14H2,1-5H3
InChIKeyCGXZHRHDPWRBTI-UHFFFAOYSA-N
MW391.49 g/mol
LogP2.88
Rot. Bonds6

About N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide

N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide (PubChem CID 3434054) has the molecular formula C21H30FN3O3 and a molecular weight of 391.49 g/mol. Its IUPAC name is N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide.

Molecular Properties

Compound NameN-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide
PubChem CID3434054
Molecular FormulaC21H30FN3O3
Molecular Weight391.49 g/mol
Exact Mass391.23
IUPAC NameN-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide
SMILESCC(C)CN(CC(=O)N1CC(=O)N(c2ccc(F)cc2)C1)C(=O)CC(C)(C)C
InChIInChI=1S/C21H30FN3O3/c1-15(2)11-23(18(26)10-21(3,4)5)12-19(27)24-13-20(28)25(14-24)17-8-6-16(22)7-9-17/h6-9,15H,10-14H2,1-5H3
InChIKeyCGXZHRHDPWRBTI-UHFFFAOYSA-N
XLogP2.88
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.49
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide with MolForge

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Related Compounds

4-ethyl-N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)benzamide
CID 5121903
N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)adamantane-1-carboxamide
CID 5104720
2-methoxy-N-[2-[3-(4-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)acetamide
CID 42770015
N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)naphthalene-1-sulfonamide
CID 42766574
ethyl 4-[[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-(2-methylpropyl)amino]-4-oxobutanoate
CID 3412421
N-[2-[3-(4-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-ethyl-2,2-dimethylpropanamide
CID 4115941
N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide
CID 24718563
3-tert-butyl-1-[2-[3-(4-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-1-propan-2-ylurea
CID 3495066
N-[2-[3-(4-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-propan-2-ylhexanamide
CID 4612458
N-[2-[3-(4-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(furan-2-ylmethyl)propanamide
CID 4307510
2-[[1-(4-fluorophenyl)-2-oxopyrrolidine-3-carbonyl]-(2-methylpropyl)amino]acetic acid
CID 119193122
N-[2-[3-(4-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-methylbenzamide
CID 4190375

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide?
The IUPAC name of N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide (CID 3434054) is N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide.
What is the SMILES notation for N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide?
The canonical SMILES for N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide is CC(C)CN(CC(=O)N1CC(=O)N(c2ccc(F)cc2)C1)C(=O)CC(C)(C)C.
What is the InChIKey of N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide?
The InChIKey is CGXZHRHDPWRBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30FN3O3/c1-15(2)11-23(18(26)10-21(3,4)5)12-19(27)24-13-20(28)25(14-24)17-8-6-16(22)7-9-17/h6-9,15H,10-14H2,1-5H3.
What are the key properties of N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide?
N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide has a molecular weight of 391.49 g/mol, XLogP of 2.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide is sourced from PubChem (CID 3434054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).