3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide

C19H23N5O — CID 154870074

IUPAC3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide
SMILESCN1CC(NC(=O)c2cc(-c3c[nH]c4ccccc34)n[nH]2)C(C)(C)C1
InChIInChI=1S/C19H23N5O/c1-19(2)11-24(3)10-17(19)21-18(25)16-8-15(22-23-16)13-9-20-14-7-5-4-6-12(13)14/h4-9,17,20H,10-11H2,1-3H3,(H,21,25)(H,22,23)
InChIKeyWJGKPLZXJUXRHN-UHFFFAOYSA-N
MW337.43 g/mol
LogP2.63
Rot. Bonds3

About 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide

3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide (PubChem CID 154870074) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide
PubChem CID154870074
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide
SMILESCN1CC(NC(=O)c2cc(-c3c[nH]c4ccccc34)n[nH]2)C(C)(C)C1
InChIInChI=1S/C19H23N5O/c1-19(2)11-24(3)10-17(19)21-18(25)16-8-15(22-23-16)13-9-20-14-7-5-4-6-12(13)14/h4-9,17,20H,10-11H2,1-3H3,(H,21,25)(H,22,23)
InChIKeyWJGKPLZXJUXRHN-UHFFFAOYSA-N
XLogP2.63
TPSA76.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 52.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2R)-2-hydroxycyclobutyl]-3-(1H-indol-3-yl)-1H-pyrazole-5-carboxamide
CID 136585265
N-(cyclopropylmethyl)-3-(1H-indol-3-yl)-1H-pyrazole-5-carboxamide
CID 155954366
3-(1H-indol-3-yl)-N-[(Z)-(2-methyl-1H-indol-3-yl)methylideneamino]-1H-pyrazole-5-carboxamide
CID 135954578
N-[[4-(difluoromethoxy)phenyl]methyl]-3-(1H-indol-3-yl)-1H-pyrazole-5-carboxamide
CID 166327720
N-(1-ethyl-4,4-dimethylpyrrolidin-3-yl)-3-naphthalen-2-yl-1H-pyrazole-5-carboxamide;2,2,2-trifluoroacetic acid
CID 166363408
N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-phenyl-1H-pyrazole-5-carboxamide
CID 114630661
3-(1H-indol-3-yl)-N-[2-[1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-2,3-dihydroindol-3-yl]ethyl]-1H-pyrazole-5-carboxamide
CID 166271743
N-(2,2-dimethylcyclopentyl)-1H-indazole-3-carboxamide
CID 79833072
N-(3-hydroxy-2,2-dimethylcyclobutyl)-1H-indazole-3-carboxamide
CID 114631317
N-[4-bromo-2-[3-(1H-indol-3-yl)-1H-pyrazol-5-yl]phenoxy]acetamide
CID 175647368
(E)-but-2-enedioic acid;3-[6-[(1R,5R)-6-methyl-3,6-diazabicyclo[3.2.0]heptan-3-yl]pyridazin-3-yl]-1H-indole
CID 162339514
N-[(4S)-2-cyano-2-azatricyclo[3.1.1.01,5]heptan-4-yl]-3-(2-phenoxyphenyl)-1H-pyrazole-5-carboxamide
CID 163744423

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide (CID 154870074) is 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide is CN1CC(NC(=O)c2cc(-c3c[nH]c4ccccc34)n[nH]2)C(C)(C)C1.
What is the InChIKey of 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is WJGKPLZXJUXRHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-19(2)11-24(3)10-17(19)21-18(25)16-8-15(22-23-16)13-9-20-14-7-5-4-6-12(13)14/h4-9,17,20H,10-11H2,1-3H3,(H,21,25)(H,22,23).
What are the key properties of 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide?
3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 337.43 g/mol, XLogP of 2.63, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indol-3-yl)-N-(1,4,4-trimethylpyrrolidin-3-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 154870074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).