N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide

C14H18N6O2 — CID 108530151

IUPACN-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide
SMILESCN1CCN(NC(=O)C(=O)Nc2ccc3cn[nH]c3c2)CC1
InChIInChI=1S/C14H18N6O2/c1-19-4-6-20(7-5-19)18-14(22)13(21)16-11-3-2-10-9-15-17-12(10)8-11/h2-3,8-9H,4-7H2,1H3,(H,15,17)(H,16,21)(H,18,22)
InChIKeyBMVVJNSOGZCDTI-UHFFFAOYSA-N
MW302.34 g/mol
LogP-0.22
Rot. Bonds2

About N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide

N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide (PubChem CID 108530151) has the molecular formula C14H18N6O2 and a molecular weight of 302.34 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide
PubChem CID108530151
Molecular FormulaC14H18N6O2
Molecular Weight302.34 g/mol
Exact Mass302.15
IUPAC NameN-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide
SMILESCN1CCN(NC(=O)C(=O)Nc2ccc3cn[nH]c3c2)CC1
InChIInChI=1S/C14H18N6O2/c1-19-4-6-20(7-5-19)18-14(22)13(21)16-11-3-2-10-9-15-17-12(10)8-11/h2-3,8-9H,4-7H2,1H3,(H,15,17)(H,16,21)(H,18,22)
InChIKeyBMVVJNSOGZCDTI-UHFFFAOYSA-N
XLogP-0.22
TPSA93.36 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

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2-(1H-indazol-1-yl)-N-mesitylacetamide
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2-(1H-indazol-1-yl)-N-(4-isopropylphenyl)acetamide
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1-[2-(4-Benzyl-piperidin-1-ylmethyl)-phenyl]-3-(1H-indazol-6-yl)-urea
CID 11091447
N-(1-isobutylpiperidin-3-yl)-1H-indazol-5-amine
CID 17838157
N-(1-Ethyl-4-piperidyl)-N-(1H-5-indazolyl)-amine
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N-(1-ethylpiperidin-3-yl)-1H-indazol-5-amine
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1-benzyl-N-(1H-indazol-5-yl)piperidine-4-carboxamide
CID 22933424
4-(1h-Indazol-5-yl)-6-(4-piperazin-1-ylphenyl)pyrimidin-2(1h)-one
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5-(2-(2-methoxyethyl)piperazin-1-yl)-1H-indazole
CID 44178203

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide?
The IUPAC name of N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide (CID 108530151) is N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide.
What is the SMILES notation for N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide?
The canonical SMILES for N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide is CN1CCN(NC(=O)C(=O)Nc2ccc3cn[nH]c3c2)CC1.
What is the InChIKey of N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide?
The InChIKey is BMVVJNSOGZCDTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O2/c1-19-4-6-20(7-5-19)18-14(22)13(21)16-11-3-2-10-9-15-17-12(10)8-11/h2-3,8-9H,4-7H2,1H3,(H,15,17)(H,16,21)(H,18,22).
What are the key properties of N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide?
N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide has a molecular weight of 302.34 g/mol, XLogP of -0.22, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)-N'-(4-methylpiperazin-1-yl)oxamide is sourced from PubChem (CID 108530151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).