3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide

C18H19ClN4O2 — CID 178109006

IUPAC3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide
SMILESCCc1c(Cl)ccnc1N1C[C@H](C)N(c2cccc(C(N)=O)c2)C1=O
InChIInChI=1S/C18H19ClN4O2/c1-3-14-15(19)7-8-21-17(14)22-10-11(2)23(18(22)25)13-6-4-5-12(9-13)16(20)24/h4-9,11H,3,10H2,1-2H3,(H2,20,24)/t11-/m0/s1
InChIKeyCFFWPOUMNGNTHI-NSHDSACASA-N
MW358.83 g/mol
LogP3.23
Rot. Bonds4

About 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide

3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide (PubChem CID 178109006) has the molecular formula C18H19ClN4O2 and a molecular weight of 358.83 g/mol. Its IUPAC name is 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide.

Molecular Properties

Compound Name3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide
PubChem CID178109006
Molecular FormulaC18H19ClN4O2
Molecular Weight358.83 g/mol
Exact Mass358.12
IUPAC Name3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide
SMILESCCc1c(Cl)ccnc1N1C[C@H](C)N(c2cccc(C(N)=O)c2)C1=O
InChIInChI=1S/C18H19ClN4O2/c1-3-14-15(19)7-8-21-17(14)22-10-11(2)23(18(22)25)13-6-4-5-12(9-13)16(20)24/h4-9,11H,3,10H2,1-2H3,(H2,20,24)/t11-/m0/s1
InChIKeyCFFWPOUMNGNTHI-NSHDSACASA-N
XLogP3.23
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.83
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide
CID 178108892
3-[(5S)-3-(4-chloro-3-fluoro-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]-N-methylbenzamide
CID 178109515
3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]-N-methylbenzamide
CID 178108896
3-[3-[4-[4-(3,4-dimethyl-5-oxo-1,2,4-triazol-1-yl)phenyl]-3-ethyl-2-pyridinyl]-2-oxoimidazolidin-1-yl]benzamide
CID 178109284
3-[5-ethyl-3-[4-[4-(3-methoxy-1-methyl-5-oxo-1,2,4-triazol-4-yl)phenyl]-3-methyl-2-pyridinyl]-2-oxoimidazolidin-1-yl]benzamide
CID 178109172
3-[3-[3-ethyl-4-[4-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)phenyl]-2-pyridinyl]-2-oxoimidazolidin-1-yl]benzamide
CID 178109310
3-[3-(4-chloro-3-methyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzoic acid
CID 178109378
3-[(5S)-3-[3-fluoro-4-[4-(3-methoxy-1-methyl-5-oxo-1,2,4-triazol-4-yl)phenyl]-2-pyridinyl]-5-methyl-2-oxoimidazolidin-1-yl]-N-methylbenzamide
CID 178109449
3-[(5S)-3-[3-fluoro-4-[5-(3-methoxy-1-methyl-5-oxo-1,2,4-triazol-4-yl)-2-pyridinyl]-6-methyl-2-pyridinyl]-5-methyl-2-oxoimidazolidin-1-yl]benzamide
CID 178109144
methyl 3-[3-(4-chloro-3-fluoro-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzoate
CID 178108846
3-[2-(1-aminobutyl)-5,8-dichloro-4-oxoquinazolin-3-yl]benzamide
CID 118571504
1-(3-carbamoylphenyl)-2,4-dimethyl-6-oxopiperidine-3-carboxylic acid
CID 107811853

Frequently Asked Questions

What is the IUPAC name of 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide?
The IUPAC name of 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide (CID 178109006) is 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide.
What is the SMILES notation for 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide?
The canonical SMILES for 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide is CCc1c(Cl)ccnc1N1C[C@H](C)N(c2cccc(C(N)=O)c2)C1=O.
What is the InChIKey of 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide?
The InChIKey is CFFWPOUMNGNTHI-NSHDSACASA-N. The full InChI is InChI=1S/C18H19ClN4O2/c1-3-14-15(19)7-8-21-17(14)22-10-11(2)23(18(22)25)13-6-4-5-12(9-13)16(20)24/h4-9,11H,3,10H2,1-2H3,(H2,20,24)/t11-/m0/s1.
What are the key properties of 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide?
3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide has a molecular weight of 358.83 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5S)-3-(4-chloro-3-ethyl-2-pyridinyl)-5-methyl-2-oxoimidazolidin-1-yl]benzamide is sourced from PubChem (CID 178109006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).