4-(4-propoxyphenyl)benzamide

C16H17NO2 — CID 23771495

IUPAC4-(4-propoxyphenyl)benzamide
SMILESCCCOc1ccc(-c2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C16H17NO2/c1-2-11-19-15-9-7-13(8-10-15)12-3-5-14(6-4-12)16(17)18/h3-10H,2,11H2,1H3,(H2,17,18)
InChIKeyDPLMJMOEDCYPOR-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.24
Rot. Bonds5

About 4-(4-propoxyphenyl)benzamide

4-(4-propoxyphenyl)benzamide (PubChem CID 23771495) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 4-(4-propoxyphenyl)benzamide.

Molecular Properties

Compound Name4-(4-propoxyphenyl)benzamide
PubChem CID23771495
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name4-(4-propoxyphenyl)benzamide
SMILESCCCOc1ccc(-c2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C16H17NO2/c1-2-11-19-15-9-7-13(8-10-15)12-3-5-14(6-4-12)16(17)18/h3-10H,2,11H2,1H3,(H2,17,18)
InChIKeyDPLMJMOEDCYPOR-UHFFFAOYSA-N
XLogP3.24
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-ethoxyphenyl)benzamide
CID 163572533
4-[(4-propoxyphenoxy)methyl]benzamide
CID 24605968
1-[4-[4-(4-propoxyphenyl)phenyl]phenyl]ethanone
CID 59457885
4-[4-(6-methylheptoxy)phenyl]benzamide
CID 58276365
4-butoxybenzamide;ethyl carbonochloridate
CID 174486229
2-amino-1-(4-propoxyphenyl)ethanone;hydrochloride
CID 50988222
2-(4-heptoxyphenyl)pyrimidine-5-carboxamide
CID 14745788
methyl 3-(4-carbamoylphenoxy)propanoate
CID 28879864
3-propoxybenzamide
CID 22311435
ethyl 4-(4-pentoxyphenyl)benzoate
CID 70928367
propyl 4-butoxybenzoate
CID 43389566
2-methyl-1-(4-propoxyphenyl)propan-1-one
CID 595976

Frequently Asked Questions

What is the IUPAC name of 4-(4-propoxyphenyl)benzamide?
The IUPAC name of 4-(4-propoxyphenyl)benzamide (CID 23771495) is 4-(4-propoxyphenyl)benzamide.
What is the SMILES notation for 4-(4-propoxyphenyl)benzamide?
The canonical SMILES for 4-(4-propoxyphenyl)benzamide is CCCOc1ccc(-c2ccc(C(N)=O)cc2)cc1.
What is the InChIKey of 4-(4-propoxyphenyl)benzamide?
The InChIKey is DPLMJMOEDCYPOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-2-11-19-15-9-7-13(8-10-15)12-3-5-14(6-4-12)16(17)18/h3-10H,2,11H2,1H3,(H2,17,18).
What are the key properties of 4-(4-propoxyphenyl)benzamide?
4-(4-propoxyphenyl)benzamide has a molecular weight of 255.32 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propoxyphenyl)benzamide is sourced from PubChem (CID 23771495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).