N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide

C21H17N3O2 — CID 34150556

IUPACN-(1H-indazol-7-yl)-3-phenylmethoxybenzamide
SMILESO=C(Nc1cccc2cn[nH]c12)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C21H17N3O2/c25-21(23-19-11-5-9-17-13-22-24-20(17)19)16-8-4-10-18(12-16)26-14-15-6-2-1-3-7-15/h1-13H,14H2,(H,22,24)(H,23,25)
InChIKeyAPTCEWNXZGLCSR-UHFFFAOYSA-N
MW343.39 g/mol
LogP4.39
Rot. Bonds5

About N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide

N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide (PubChem CID 34150556) has the molecular formula C21H17N3O2 and a molecular weight of 343.39 g/mol. Its IUPAC name is N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-(1H-indazol-7-yl)-3-phenylmethoxybenzamide
PubChem CID34150556
Molecular FormulaC21H17N3O2
Molecular Weight343.39 g/mol
Exact Mass343.13
IUPAC NameN-(1H-indazol-7-yl)-3-phenylmethoxybenzamide
SMILESO=C(Nc1cccc2cn[nH]c12)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C21H17N3O2/c25-21(23-19-11-5-9-17-13-22-24-20(17)19)16-8-4-10-18(12-16)26-14-15-6-2-1-3-7-15/h1-13H,14H2,(H,22,24)(H,23,25)
InChIKeyAPTCEWNXZGLCSR-UHFFFAOYSA-N
XLogP4.39
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-3-phenylmethoxybenzamide
CID 801132
2-[2-[[3-[(3-phenylmethoxyphenyl)methoxy]benzoyl]amino]phenyl]acetic acid
CID 66912833
N-[3-(1H-indazol-7-ylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 46411479
N-(2-nitrophenyl)-3-phenylmethoxybenzamide
CID 23854961
N-(1H-indazol-7-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43712758
N-[2-methyl-3-(propanoylamino)phenyl]-3-phenylmethoxybenzamide
CID 38300494
3-ethoxy-N-(2-phenylmethoxyphenyl)benzamide
CID 17093571
N-(3,4-dichlorophenyl)-3-phenylmethoxybenzamide
CID 17148514
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide
CID 26522423
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-3-phenylmethoxybenzamide
CID 17102550
N-(6-phenylmethoxy-3-pyridinyl)-3-(pyridin-3-ylmethoxy)benzamide
CID 55880084
3-phenylmethoxy-N-(3-piperidin-1-yl-1H-1,2,4-triazol-5-yl)benzamide
CID 56527384

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide?
The IUPAC name of N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide (CID 34150556) is N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide.
What is the SMILES notation for N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide?
The canonical SMILES for N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide is O=C(Nc1cccc2cn[nH]c12)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide?
The InChIKey is APTCEWNXZGLCSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2/c25-21(23-19-11-5-9-17-13-22-24-20(17)19)16-8-4-10-18(12-16)26-14-15-6-2-1-3-7-15/h1-13H,14H2,(H,22,24)(H,23,25).
What are the key properties of N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide?
N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide has a molecular weight of 343.39 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-7-yl)-3-phenylmethoxybenzamide is sourced from PubChem (CID 34150556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).