4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide

C18H23N5O2 — CID 96518937

IUPAC4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide
SMILESCCC[C@H](C)c1cc(NC(=O)c2ccc(N3CCNC3=O)cc2)n[nH]1
InChIInChI=1S/C18H23N5O2/c1-3-4-12(2)15-11-16(22-21-15)20-17(24)13-5-7-14(8-6-13)23-10-9-19-18(23)25/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,19,25)(H2,20,21,22,24)/t12-/m0/s1
InChIKeyHMQPUDKPVKNBQJ-LBPRGKRZSA-N
MW341.42 g/mol
LogP3.10
Rot. Bonds6

About 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide

4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide (PubChem CID 96518937) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide.

Molecular Properties

Compound Name4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide
PubChem CID96518937
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC Name4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide
SMILESCCC[C@H](C)c1cc(NC(=O)c2ccc(N3CCNC3=O)cc2)n[nH]1
InChIInChI=1S/C18H23N5O2/c1-3-4-12(2)15-11-16(22-21-15)20-17(24)13-5-7-14(8-6-13)23-10-9-19-18(23)25/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,19,25)(H2,20,21,22,24)/t12-/m0/s1
InChIKeyHMQPUDKPVKNBQJ-LBPRGKRZSA-N
XLogP3.10
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 53.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide with MolForge

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Related Compounds

1-methyl-2-oxo-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]pyridine-4-carboxamide
CID 124607479
N-(5-pentan-2-yl-1H-pyrazol-3-yl)pyridine-3-carboxamide
CID 71989878
N-(3-aminobutyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 119497450
1-[4-(heptan-4-ylamino)phenyl]imidazolidin-2-one
CID 43724866
N-[5-[(2R)-pentan-2-yl]-1H-pyrazol-3-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 96518938
4-chloro-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 51299854
4-(2-oxoimidazolidin-1-yl)-N-(4-pentylphenyl)benzamide
CID 134055766
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 134055670
N-[5-chloro-2-(propylamino)phenyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 75382285
N-(2,6-dimethylphenyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 110857589
N-(3-methoxy-5-pyrazol-1-ylphenyl)-4-(2-oxoimidazolidin-1-yl)benzamide
CID 136538638
(2S)-3-methyl-2-[[4-(2-oxoimidazolidin-1-yl)benzoyl]amino]butanoic acid
CID 119360751

Frequently Asked Questions

What is the IUPAC name of 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide?
The IUPAC name of 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide (CID 96518937) is 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide.
What is the SMILES notation for 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide?
The canonical SMILES for 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide is CCC[C@H](C)c1cc(NC(=O)c2ccc(N3CCNC3=O)cc2)n[nH]1.
What is the InChIKey of 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide?
The InChIKey is HMQPUDKPVKNBQJ-LBPRGKRZSA-N. The full InChI is InChI=1S/C18H23N5O2/c1-3-4-12(2)15-11-16(22-21-15)20-17(24)13-5-7-14(8-6-13)23-10-9-19-18(23)25/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,19,25)(H2,20,21,22,24)/t12-/m0/s1.
What are the key properties of 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide?
4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide has a molecular weight of 341.42 g/mol, XLogP of 3.10, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxoimidazolidin-1-yl)-N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]benzamide is sourced from PubChem (CID 96518937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).