1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one

C17H21N5O3 — CID 129399347

IUPAC1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one
SMILESCOc1ccc(Cn2ccc(N[C@H](C)C(=O)N3CCNC3=O)n2)cc1
InChIInChI=1S/C17H21N5O3/c1-12(16(23)22-10-8-18-17(22)24)19-15-7-9-21(20-15)11-13-3-5-14(25-2)6-4-13/h3-7,9,12H,8,10-11H2,1-2H3,(H,18,24)(H,19,20)/t12-/m1/s1
InChIKeyCQUBITASKBMYNQ-GFCCVEGCSA-N
MW343.39 g/mol
LogP1.29
Rot. Bonds6

About 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one

1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one (PubChem CID 129399347) has the molecular formula C17H21N5O3 and a molecular weight of 343.39 g/mol. Its IUPAC name is 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one
PubChem CID129399347
Molecular FormulaC17H21N5O3
Molecular Weight343.39 g/mol
Exact Mass343.16
IUPAC Name1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one
SMILESCOc1ccc(Cn2ccc(N[C@H](C)C(=O)N3CCNC3=O)n2)cc1
InChIInChI=1S/C17H21N5O3/c1-12(16(23)22-10-8-18-17(22)24)19-15-7-9-21(20-15)11-13-3-5-14(25-2)6-4-13/h3-7,9,12H,8,10-11H2,1-2H3,(H,18,24)(H,19,20)/t12-/m1/s1
InChIKeyCQUBITASKBMYNQ-GFCCVEGCSA-N
XLogP1.29
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]-3-methyl-6-oxopiperidine-3-carboxamide
CID 136539957
1-[(2S)-2-(4-chloroanilino)propanoyl]imidazolidin-2-one
CID 39975330
[1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] (2S)-2-[3-(4-methoxyphenyl)prop-2-enoylamino]propanoate
CID 55934709
1-(1-benzylpyrazol-3-yl)-3-(4-methoxyphenyl)urea
CID 17266369
1-[2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoyl]imidazolidin-2-one
CID 18091387
3-N-[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]benzene-1,3-dicarboxamide
CID 136533551
3-iodo-1-[(4-methoxyphenyl)methyl]pyrazole
CID 122574019
1-[(2S)-2-[(3-methoxyphenyl)methyl-methylamino]propanoyl]imidazolidin-2-one
CID 8789162
1-[(4-methoxyphenyl)methyl]-N-phenylpyrazole-3-carboxamide
CID 154079523
[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]boronic acid
CID 175477435
1-[(2S)-2-(3-methoxyphenyl)sulfanylpropanoyl]imidazolidin-2-one
CID 35041841
2-(4-bromophenoxy)-N-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]propanamide
CID 2970557

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one?
The IUPAC name of 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one (CID 129399347) is 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one.
What is the SMILES notation for 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one?
The canonical SMILES for 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one is COc1ccc(Cn2ccc(N[C@H](C)C(=O)N3CCNC3=O)n2)cc1.
What is the InChIKey of 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one?
The InChIKey is CQUBITASKBMYNQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H21N5O3/c1-12(16(23)22-10-8-18-17(22)24)19-15-7-9-21(20-15)11-13-3-5-14(25-2)6-4-13/h3-7,9,12H,8,10-11H2,1-2H3,(H,18,24)(H,19,20)/t12-/m1/s1.
What are the key properties of 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one?
1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one has a molecular weight of 343.39 g/mol, XLogP of 1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-[[1-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one is sourced from PubChem (CID 129399347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).