3-chloro-5-methoxy-4-phenylmethoxybenzamide

C15H14ClNO3 — CID 847701

IUPAC3-chloro-5-methoxy-4-phenylmethoxybenzamide
SMILESCOc1cc(C(N)=O)cc(Cl)c1OCc1ccccc1
InChIInChI=1S/C15H14ClNO3/c1-19-13-8-11(15(17)18)7-12(16)14(13)20-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H2,17,18)
InChIKeySSPRAVYIUOHFLM-UHFFFAOYSA-N
MW291.73 g/mol
LogP3.03
Rot. Bonds5

About 3-chloro-5-methoxy-4-phenylmethoxybenzamide

3-chloro-5-methoxy-4-phenylmethoxybenzamide (PubChem CID 847701) has the molecular formula C15H14ClNO3 and a molecular weight of 291.73 g/mol. Its IUPAC name is 3-chloro-5-methoxy-4-phenylmethoxybenzamide.

Molecular Properties

Compound Name3-chloro-5-methoxy-4-phenylmethoxybenzamide
PubChem CID847701
Molecular FormulaC15H14ClNO3
Molecular Weight291.73 g/mol
Exact Mass291.07
IUPAC Name3-chloro-5-methoxy-4-phenylmethoxybenzamide
SMILESCOc1cc(C(N)=O)cc(Cl)c1OCc1ccccc1
InChIInChI=1S/C15H14ClNO3/c1-19-13-8-11(15(17)18)7-12(16)14(13)20-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H2,17,18)
InChIKeySSPRAVYIUOHFLM-UHFFFAOYSA-N
XLogP3.03
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.73
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 974247
CID 974247
CID 2224301
CID 2224301
CID 127046854
CID 127046854
CID 900807
CID 900807
CID 889956
CID 889956
CID 847700
CID 847700
CID 44405331
CID 44405331
CID 137640828
CID 137640828
CID 137651229
CID 137651229
CID 137652925
CID 137652925
CID 570588
CID 570588
CID 977097
CID 977097

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-methoxy-4-phenylmethoxybenzamide?
The IUPAC name of 3-chloro-5-methoxy-4-phenylmethoxybenzamide (CID 847701) is 3-chloro-5-methoxy-4-phenylmethoxybenzamide.
What is the SMILES notation for 3-chloro-5-methoxy-4-phenylmethoxybenzamide?
The canonical SMILES for 3-chloro-5-methoxy-4-phenylmethoxybenzamide is COc1cc(C(N)=O)cc(Cl)c1OCc1ccccc1.
What is the InChIKey of 3-chloro-5-methoxy-4-phenylmethoxybenzamide?
The InChIKey is SSPRAVYIUOHFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO3/c1-19-13-8-11(15(17)18)7-12(16)14(13)20-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H2,17,18).
What are the key properties of 3-chloro-5-methoxy-4-phenylmethoxybenzamide?
3-chloro-5-methoxy-4-phenylmethoxybenzamide has a molecular weight of 291.73 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-methoxy-4-phenylmethoxybenzamide is sourced from PubChem (CID 847701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).