N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide

C19H20N4O4 — CID 162663710

IUPACN'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide
SMILESCOc1cccc(-c2ccc3c(NC(=O)CCCC(=O)NO)n[nH]c3c2)c1
InChIInChI=1S/C19H20N4O4/c1-27-14-5-2-4-12(10-14)13-8-9-15-16(11-13)21-22-19(15)20-17(24)6-3-7-18(25)23-26/h2,4-5,8-11,26H,3,6-7H2,1H3,(H,23,25)(H2,20,21,22,24)
InChIKeyCWVHTMDIWNFNQO-UHFFFAOYSA-N
MW368.39 g/mol
LogP2.85
Rot. Bonds7

About N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide

N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide (PubChem CID 162663710) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide.

Molecular Properties

Compound NameN'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide
PubChem CID162663710
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC NameN'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide
SMILESCOc1cccc(-c2ccc3c(NC(=O)CCCC(=O)NO)n[nH]c3c2)c1
InChIInChI=1S/C19H20N4O4/c1-27-14-5-2-4-12(10-14)13-8-9-15-16(11-13)21-22-19(15)20-17(24)6-3-7-18(25)23-26/h2,4-5,8-11,26H,3,6-7H2,1H3,(H,23,25)(H2,20,21,22,24)
InChIKeyCWVHTMDIWNFNQO-UHFFFAOYSA-N
XLogP2.85
TPSA116.34 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 52.85
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(6-(3-hydroxyphenyl)-1H-indazol-3-yl)butyramide
CID 22319573
4-(4-ethylpiperazin-1-yl)-N-[6-(2-fluoro-3-methoxyphenyl)-1H-indazol-3-yl]benzamide
CID 91827382
N-[6-(4-Hydroxyphenyl)-1h-Indazol-3-Yl]butanamide
CID 135458003
4-(4-Ethylpiperazin-1-Yl)-N-[6-(3-Methoxyphenyl)-2h-Indazol-3-Yl]benzamide
CID 91801169
N-(6-(4-hydroxyphenyl)-1H-indazol-3-yl)cyclopropanecarboxamide
CID 135435018
Fgfr2-IN-1
CID 157049296
N-(6-(3,4-dihydroxyphenyl)-1H-indazol-3-yl)butyramide
CID 135848025
N-[6-(3-fluoro-5-methoxyphenyl)-1H-indazol-3-yl]-2-(prop-2-enoylamino)benzamide
CID 162654484
N-[6-(4-methoxyphenyl)-1H-indazol-3-yl]-2-(prop-2-enoylamino)benzamide
CID 162658664
N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]-2-(prop-2-enoylamino)benzamide
CID 162660618
N-[6-(2-fluoro-5-methoxyphenyl)-1H-indazol-3-yl]-2-(prop-2-enoylamino)benzamide
CID 162670414
N-[6-(2-fluoro-3-methoxyphenyl)-1H-indazol-3-yl]-2-(prop-2-enoylamino)benzamide
CID 162672531

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide?
The IUPAC name of N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide (CID 162663710) is N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide.
What is the SMILES notation for N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide?
The canonical SMILES for N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide is COc1cccc(-c2ccc3c(NC(=O)CCCC(=O)NO)n[nH]c3c2)c1.
What is the InChIKey of N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide?
The InChIKey is CWVHTMDIWNFNQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4/c1-27-14-5-2-4-12(10-14)13-8-9-15-16(11-13)21-22-19(15)20-17(24)6-3-7-18(25)23-26/h2,4-5,8-11,26H,3,6-7H2,1H3,(H,23,25)(H2,20,21,22,24).
What are the key properties of N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide?
N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide has a molecular weight of 368.39 g/mol, XLogP of 2.85, 7 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide is sourced from PubChem (CID 162663710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).