N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide

C17H19NO3 — CID 61151190

IUPACN-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide
SMILESCCCOc1cccc(C(=O)NCc2cccc(O)c2)c1
InChIInChI=1S/C17H19NO3/c1-2-9-21-16-8-4-6-14(11-16)17(20)18-12-13-5-3-7-15(19)10-13/h3-8,10-11,19H,2,9,12H2,1H3,(H,18,20)
InChIKeyRWMVZIDCPLFLSJ-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.11
Rot. Bonds6

About N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide

N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide (PubChem CID 61151190) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide.

Molecular Properties

Compound NameN-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide
PubChem CID61151190
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC NameN-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide
SMILESCCCOc1cccc(C(=O)NCc2cccc(O)c2)c1
InChIInChI=1S/C17H19NO3/c1-2-9-21-16-8-4-6-14(11-16)17(20)18-12-13-5-3-7-15(19)10-13/h3-8,10-11,19H,2,9,12H2,1H3,(H,18,20)
InChIKeyRWMVZIDCPLFLSJ-UHFFFAOYSA-N
XLogP3.11
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-hydroxyphenyl)methyl]-3-methoxybenzamide
CID 47292174
N-[(4-aminophenyl)methyl]-3-propoxybenzamide
CID 62921372
3-propoxy-N-[2-[(3-propoxybenzoyl)amino]ethyl]benzamide
CID 4960567
3-propoxy-N-(1H-pyrazol-4-ylmethyl)benzamide
CID 60968015
N-[(4-propan-2-yloxyphenyl)methyl]-3-propoxybenzamide
CID 43911104
N-benzyl-2-[(3-propoxybenzoyl)amino]benzamide
CID 4960084
3-propoxy-N-[3-[(3-propoxybenzoyl)amino]propyl]benzamide
CID 4960565
N'-benzoyl-3-propoxybenzohydrazide
CID 4960188
N-(2-hydroxy-3-phenylpropyl)-3-propoxybenzamide
CID 111102702
N-(2-methylprop-2-enyl)-3-propoxybenzamide
CID 114618945
N-[2-(ethylamino)ethyl]-3-propoxybenzamide
CID 62919691
N-[(3-butoxyphenyl)methyl]-3-(methylsulfonylmethyl)benzamide
CID 55749632

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide?
The IUPAC name of N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide (CID 61151190) is N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide.
What is the SMILES notation for N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide?
The canonical SMILES for N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide is CCCOc1cccc(C(=O)NCc2cccc(O)c2)c1.
What is the InChIKey of N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide?
The InChIKey is RWMVZIDCPLFLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-2-9-21-16-8-4-6-14(11-16)17(20)18-12-13-5-3-7-15(19)10-13/h3-8,10-11,19H,2,9,12H2,1H3,(H,18,20).
What are the key properties of N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide?
N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide has a molecular weight of 285.34 g/mol, XLogP of 3.11, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxyphenyl)methyl]-3-propoxybenzamide is sourced from PubChem (CID 61151190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).