N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide

C11H12ClN3O2 — CID 135143194

IUPACN-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide
SMILESCN1CN(C(=O)Nc2ccc(Cl)cc2)CC1=O
InChIInChI=1S/C11H12ClN3O2/c1-14-7-15(6-10(14)16)11(17)13-9-4-2-8(12)3-5-9/h2-5H,6-7H2,1H3,(H,13,17)
InChIKeyMPTJDXFERQPUBZ-UHFFFAOYSA-N
MW253.69 g/mol
LogP1.60
Rot. Bonds1

About N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide

N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide (PubChem CID 135143194) has the molecular formula C11H12ClN3O2 and a molecular weight of 253.69 g/mol. Its IUPAC name is N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide
PubChem CID135143194
Molecular FormulaC11H12ClN3O2
Molecular Weight253.69 g/mol
Exact Mass253.06
IUPAC NameN-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide
SMILESCN1CN(C(=O)Nc2ccc(Cl)cc2)CC1=O
InChIInChI=1S/C11H12ClN3O2/c1-14-7-15(6-10(14)16)11(17)13-9-4-2-8(12)3-5-9/h2-5H,6-7H2,1H3,(H,13,17)
InChIKeyMPTJDXFERQPUBZ-UHFFFAOYSA-N
XLogP1.60
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.69
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-[4-(4-methylphenoxy)phenyl]-4-oxoimidazolidine-1-carboxamide
CID 136530574
4-[(4-methyl-3-oxopiperazine-1-carbonyl)amino]benzoic acid
CID 64695553
N-(4-chlorophenyl)-4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3-oxopiperazine-1-carboxamide
CID 50831289
(3R,4S)-N-(4-chlorophenyl)-3,4-dihydroxypyrrolidine-1-carboxamide
CID 79411419
2-chloro-4-[(4-methyl-3-oxopiperazine-1-carbonyl)amino]benzoic acid
CID 64694531
N-(4-chlorophenyl)-4-propylpiperazin-4-ium-1-carboxamide
CID 9166248
methyl 2-[4-[(4-chlorophenyl)carbamoyl]piperazin-1-yl]acetate
CID 17478962
N-(4-chlorophenyl)-3-(4-methylpiperazin-1-yl)azetidine-1-carboxamide
CID 23140487
N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride
CID 165430478
(5S)-7-N-(4-chlorophenyl)-2-methyl-3-oxo-10-N-propan-2-yl-2,7,10-triazaspiro[4.6]undecane-7,10-dicarboxamide
CID 97439023
N-(4-chlorophenyl)-1,3-oxazolidine-3-carboxamide
CID 110749558
1-N,4-N-bis(4-chlorophenyl)-2-methylpiperazine-1,4-dicarboxamide
CID 4052686

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide (CID 135143194) is N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide is CN1CN(C(=O)Nc2ccc(Cl)cc2)CC1=O.
What is the InChIKey of N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide?
The InChIKey is MPTJDXFERQPUBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3O2/c1-14-7-15(6-10(14)16)11(17)13-9-4-2-8(12)3-5-9/h2-5H,6-7H2,1H3,(H,13,17).
What are the key properties of N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide?
N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide has a molecular weight of 253.69 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-3-methyl-4-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 135143194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).