N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide

C19H21N5O — CID 69063807

IUPACN-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide
SMILESCc1ccc(-c2ccc3c(NC(=O)N4CCNCC4)n[nH]c3c2)cc1
InChIInChI=1S/C19H21N5O/c1-13-2-4-14(5-3-13)15-6-7-16-17(12-15)22-23-18(16)21-19(25)24-10-8-20-9-11-24/h2-7,12,20H,8-11H2,1H3,(H2,21,22,23,25)
InChIKeyQJGXGIJZBASZHQ-UHFFFAOYSA-N
MW335.41 g/mol
LogP2.98
Rot. Bonds2

About N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide

N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide (PubChem CID 69063807) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide.

Molecular Properties

Compound NameN-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide
PubChem CID69063807
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC NameN-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide
SMILESCc1ccc(-c2ccc3c(NC(=O)N4CCNCC4)n[nH]c3c2)cc1
InChIInChI=1S/C19H21N5O/c1-13-2-4-14(5-3-13)15-6-7-16-17(12-15)22-23-18(16)21-19(25)24-10-8-20-9-11-24/h2-7,12,20H,8-11H2,1H3,(H2,21,22,23,25)
InChIKeyQJGXGIJZBASZHQ-UHFFFAOYSA-N
XLogP2.98
TPSA73.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
CID 69064183
N-[6-(4-fluorophenyl)-1H-indazol-3-yl]-4-methylpiperidine-1-carboxamide
CID 58135453
4-hydroxy-N-[6-(4-methoxyphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
CID 69061015
N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pyrrolidine-1-carboxamide
CID 69069520
3-methyl-N-[6-(4-propan-2-ylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
CID 58135508
2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide
CID 69061785
N-[6-(4-methoxyphenyl)-1H-indazol-3-yl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 69062932
N-[2-[[6-(4-methylphenyl)-1H-indazol-3-yl]carbamoylamino]ethyl]acetamide
CID 69091931
1-N-[6-(3,5-dimethylphenyl)-1H-indazol-3-yl]-3-N,3-N-diethylpiperidine-1,3-dicarboxamide
CID 50943435
1-(3-hydroxypropyl)-3-[6-(4-methylphenyl)-1H-indazol-3-yl]urea
CID 69064539
N-[6-(3-cyanophenyl)-1H-indazol-3-yl]-3-methyl-4-(3-methylphenyl)piperazine-1-carboxamide
CID 50943508
2,3,4,5-tetrafluoro-N-[6-(4-methylphenyl)-1H-indazol-3-yl]benzamide
CID 87678347

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide?
The IUPAC name of N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide (CID 69063807) is N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide.
What is the SMILES notation for N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide?
The canonical SMILES for N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide is Cc1ccc(-c2ccc3c(NC(=O)N4CCNCC4)n[nH]c3c2)cc1.
What is the InChIKey of N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide?
The InChIKey is QJGXGIJZBASZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c1-13-2-4-14(5-3-13)15-6-7-16-17(12-15)22-23-18(16)21-19(25)24-10-8-20-9-11-24/h2-7,12,20H,8-11H2,1H3,(H2,21,22,23,25).
What are the key properties of N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide?
N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 2.98, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide is sourced from PubChem (CID 69063807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).