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

C19H16N4O2 — CID 135508415

IUPACN-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc3[nH]c(-c4ccn[nH]4)cc3c2)cc1
InChIInChI=1S/C19H16N4O2/c1-25-15-5-3-14(4-6-15)21-19(24)12-2-7-16-13(10-12)11-18(22-16)17-8-9-20-23-17/h2-11,22H,1H3,(H,20,23)(H,21,24)
InChIKeyQCOWOHIHCKVORN-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.82
Rot. Bonds4

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

N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide (PubChem CID 135508415) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide
PubChem CID135508415
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC NameN-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc3[nH]c(-c4ccn[nH]4)cc3c2)cc1
InChIInChI=1S/C19H16N4O2/c1-25-15-5-3-14(4-6-15)21-19(24)12-2-7-16-13(10-12)11-18(22-16)17-8-9-20-23-17/h2-11,22H,1H3,(H,20,23)(H,21,24)
InChIKeyQCOWOHIHCKVORN-UHFFFAOYSA-N
XLogP3.82
TPSA82.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide (CID 135508415) is N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide is COc1ccc(NC(=O)c2ccc3[nH]c(-c4ccn[nH]4)cc3c2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide?
The InChIKey is QCOWOHIHCKVORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c1-25-15-5-3-14(4-6-15)21-19(24)12-2-7-16-13(10-12)11-18(22-16)17-8-9-20-23-17/h2-11,22H,1H3,(H,20,23)(H,21,24).
What are the key properties of N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide?
N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 3.82, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide is sourced from PubChem (CID 135508415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).