N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide

C23H24N4O — CID 135507462

IUPACN-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide
SMILESCCCN(CCc1ccccc1)C(=O)c1cccc2[nH]c(-c3ccn[nH]3)cc12
InChIInChI=1S/C23H24N4O/c1-2-14-27(15-12-17-7-4-3-5-8-17)23(28)18-9-6-10-20-19(18)16-22(25-20)21-11-13-24-26-21/h3-11,13,16,25H,2,12,14-15H2,1H3,(H,24,26)
InChIKeyDRHFYIGAESGYSP-UHFFFAOYSA-N
MW372.47 g/mol
LogP4.65
Rot. Bonds7

About N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide

N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide (PubChem CID 135507462) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide
PubChem CID135507462
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC NameN-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide
SMILESCCCN(CCc1ccccc1)C(=O)c1cccc2[nH]c(-c3ccn[nH]3)cc12
InChIInChI=1S/C23H24N4O/c1-2-14-27(15-12-17-7-4-3-5-8-17)23(28)18-9-6-10-20-19(18)16-22(25-20)21-11-13-24-26-21/h3-11,13,16,25H,2,12,14-15H2,1H3,(H,24,26)
InChIKeyDRHFYIGAESGYSP-UHFFFAOYSA-N
XLogP4.65
TPSA64.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-oxo-N-(2-pyridin-4-ylethyl)-1H-quinoline-4-carboxamide
CID 110694438
N-(2-hydroxyethyl)-2-methyl-N-(2-phenylethyl)benzamide
CID 111122128
2-amino-N-ethyl-3-fluoro-N-(2-phenylethyl)benzamide
CID 81499615
2,3-dichloro-N-ethyl-N-(2-phenylethyl)benzamide
CID 52573948
N-(2-hydroxyethyl)-N-(2-phenylethyl)-1H-indazole-3-carboxamide
CID 111122221
benzyl N-(2-phenylethyl)-N-propylcarbamate
CID 141214561
4-N-(2-aminoethyl)-1-N-ethyl-4-N-(2-phenylethyl)-1-N-propylbenzene-1,4-dicarboxamide
CID 120884506
N-(2-hydroxyethyl)-5-oxo-N-(2-phenylethyl)-1,4-dihydro-1,2,4-triazole-3-carboxamide
CID 136703892
N-(5-oxo-1,2-dihydropyrazol-3-yl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-6-carboxamide
CID 136601467
2-[acetyl(2-phenylethyl)amino]-N,N-dipropylacetamide
CID 113164026
N-propyl-N-(2-pyridin-2-ylethyl)-1H-indazole-3-carboxamide
CID 52768641
2-[(2,3-dimethylbenzoyl)-(2-phenylethyl)amino]acetic acid
CID 119347338

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide?
The IUPAC name of N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide (CID 135507462) is N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide.
What is the SMILES notation for N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide?
The canonical SMILES for N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide is CCCN(CCc1ccccc1)C(=O)c1cccc2[nH]c(-c3ccn[nH]3)cc12.
What is the InChIKey of N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide?
The InChIKey is DRHFYIGAESGYSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O/c1-2-14-27(15-12-17-7-4-3-5-8-17)23(28)18-9-6-10-20-19(18)16-22(25-20)21-11-13-24-26-21/h3-11,13,16,25H,2,12,14-15H2,1H3,(H,24,26).
What are the key properties of N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide?
N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide has a molecular weight of 372.47 g/mol, XLogP of 4.65, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide is sourced from PubChem (CID 135507462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).