3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide

C19H24N4O2 — CID 164642145

IUPAC3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide
SMILESCCc1nccn1CCC(=O)Nc1ccc(N2C(=O)CC[C@@H]2C)cc1
InChIInChI=1S/C19H24N4O2/c1-3-17-20-11-13-22(17)12-10-18(24)21-15-5-7-16(8-6-15)23-14(2)4-9-19(23)25/h5-8,11,13-14H,3-4,9-10,12H2,1-2H3,(H,21,24)/t14-/m0/s1
InChIKeyAQVUEFOETHTQDJ-AWEZNQCLSA-N
MW340.43 g/mol
LogP2.99
Rot. Bonds6

About 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide

3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide (PubChem CID 164642145) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide.

Molecular Properties

Compound Name3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide
PubChem CID164642145
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide
SMILESCCc1nccn1CCC(=O)Nc1ccc(N2C(=O)CC[C@@H]2C)cc1
InChIInChI=1S/C19H24N4O2/c1-3-17-20-11-13-22(17)12-10-18(24)21-15-5-7-16(8-6-15)23-14(2)4-9-19(23)25/h5-8,11,13-14H,3-4,9-10,12H2,1-2H3,(H,21,24)/t14-/m0/s1
InChIKeyAQVUEFOETHTQDJ-AWEZNQCLSA-N
XLogP2.99
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1-methylimidazol-2-yl)methyl]-3-[4-[(2R)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]-1-propylurea
CID 125155347
N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-3-pyrazol-1-ylpropanamide
CID 131950301
N-(4-aminophenyl)-4-(2-ethylimidazol-1-yl)butanamide
CID 61402347
1-ethyl-N-[4-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-2-oxopyridine-4-carboxamide
CID 131888969
N-(3-amino-4-fluorophenyl)-3-(2-ethylimidazol-1-yl)propanamide
CID 61402367
2,6-dimethyl-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]pyridine-4-carboxamide
CID 164641938
N-[4-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]cyclopentanecarboxamide
CID 131948204
N-[4-(2-ethylimidazol-1-yl)phenyl]propanamide
CID 12797181
N-(2,3-dihydro-1H-inden-1-yl)-3-(2-ethylimidazol-1-yl)propanamide
CID 131896789
3-(1H-indol-3-yl)-N-[4-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]propanamide
CID 131909124
N-[4-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]-3-(2-methylpropyl)-1,2-oxazole-5-carboxamide
CID 131892415
3-(2-ethylimidazol-1-yl)propanoic acid
CID 579344

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide?
The IUPAC name of 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide (CID 164642145) is 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide.
What is the SMILES notation for 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide?
The canonical SMILES for 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide is CCc1nccn1CCC(=O)Nc1ccc(N2C(=O)CC[C@@H]2C)cc1.
What is the InChIKey of 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide?
The InChIKey is AQVUEFOETHTQDJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-3-17-20-11-13-22(17)12-10-18(24)21-15-5-7-16(8-6-15)23-14(2)4-9-19(23)25/h5-8,11,13-14H,3-4,9-10,12H2,1-2H3,(H,21,24)/t14-/m0/s1.
What are the key properties of 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide?
3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide has a molecular weight of 340.43 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylimidazol-1-yl)-N-[4-[(2S)-2-methyl-5-oxopyrrolidin-1-yl]phenyl]propanamide is sourced from PubChem (CID 164642145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).