3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide

C20H18N4O — CID 43073730

IUPAC3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide
SMILESO=C(CCc1c[nH]c2ccccc12)Nc1cccc(-c2ccn[nH]2)c1
InChIInChI=1S/C20H18N4O/c25-20(9-8-15-13-21-19-7-2-1-6-17(15)19)23-16-5-3-4-14(12-16)18-10-11-22-24-18/h1-7,10-13,21H,8-9H2,(H,22,24)(H,23,25)
InChIKeyJOAXEQPFBVUZMF-UHFFFAOYSA-N
MW330.39 g/mol
LogP4.13
Rot. Bonds5

About 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide

3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide (PubChem CID 43073730) has the molecular formula C20H18N4O and a molecular weight of 330.39 g/mol. Its IUPAC name is 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide.

Molecular Properties

Compound Name3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide
PubChem CID43073730
Molecular FormulaC20H18N4O
Molecular Weight330.39 g/mol
Exact Mass330.15
IUPAC Name3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide
SMILESO=C(CCc1c[nH]c2ccccc12)Nc1cccc(-c2ccn[nH]2)c1
InChIInChI=1S/C20H18N4O/c25-20(9-8-15-13-21-19-7-2-1-6-17(15)19)23-16-5-3-4-14(12-16)18-10-11-22-24-18/h1-7,10-13,21H,8-9H2,(H,22,24)(H,23,25)
InChIKeyJOAXEQPFBVUZMF-UHFFFAOYSA-N
XLogP4.13
TPSA73.57 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 54.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-bromophenyl)-3-(1H-indol-3-yl)propanamide
CID 7732917
3-(1H-indol-3-yl)-N-(2-methyl-4-pyridinyl)propanamide
CID 78915659
N-[2-(1H-indol-3-yl)ethyl]-3-(1H-pyrazol-5-yl)benzamide
CID 119058397
3-(1H-indol-3-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 2129206
3-(1H-indol-3-yl)-N-(3-sulfamoylphenyl)propanamide
CID 26580490
N-(3-cyanophenyl)-3-(1H-indol-3-yl)propanamide
CID 2522746
N-(3-chlorophenyl)-4-(1H-indol-3-yl)butanamide
CID 7900117
3-(1H-indol-3-yl)-N-[3-[(4S)-4-methyl-2,5-dioxoimidazolidin-4-yl]phenyl]propanamide
CID 51949276
N-(3,5-difluorophenyl)-3-(1H-indol-3-yl)propanamide
CID 27906978
N-[3-(1,3-dithian-2-yl)phenyl]-3-(1H-indol-3-yl)propanamide
CID 27842678
N-[3-bromo-4-(pyridin-3-ylamino)phenyl]-3-(1H-indol-3-yl)propanamide
CID 53385177
1-phenyl-3-[3-(1H-pyrazol-5-yl)phenyl]urea
CID 60969581

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide?
The IUPAC name of 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide (CID 43073730) is 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide.
What is the SMILES notation for 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide?
The canonical SMILES for 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide is O=C(CCc1c[nH]c2ccccc12)Nc1cccc(-c2ccn[nH]2)c1.
What is the InChIKey of 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide?
The InChIKey is JOAXEQPFBVUZMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O/c25-20(9-8-15-13-21-19-7-2-1-6-17(15)19)23-16-5-3-4-14(12-16)18-10-11-22-24-18/h1-7,10-13,21H,8-9H2,(H,22,24)(H,23,25).
What are the key properties of 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide?
3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide has a molecular weight of 330.39 g/mol, XLogP of 4.13, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indol-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]propanamide is sourced from PubChem (CID 43073730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).