4-hydroxy-3-methoxybenzamide;nonane

C17H29NO3 — CID 174831625

IUPAC4-hydroxy-3-methoxybenzamide;nonane
SMILESCCCCCCCCC.COc1cc(C(N)=O)ccc1O
InChIInChI=1S/C9H20.C8H9NO3/c1-3-5-7-9-8-6-4-2;1-12-7-4-5(8(9)11)2-3-6(7)10/h3-9H2,1-2H3;2-4,10H,1H3,(H2,9,11)
InChIKeyVQMVCIIOQHEVQJ-UHFFFAOYSA-N
MW295.42 g/mol
LogP4.26
Rot. Bonds8

About 4-hydroxy-3-methoxybenzamide;nonane

4-hydroxy-3-methoxybenzamide;nonane (PubChem CID 174831625) has the molecular formula C17H29NO3 and a molecular weight of 295.42 g/mol. Its IUPAC name is 4-hydroxy-3-methoxybenzamide;nonane.

Molecular Properties

Compound Name4-hydroxy-3-methoxybenzamide;nonane
PubChem CID174831625
Molecular FormulaC17H29NO3
Molecular Weight295.42 g/mol
Exact Mass295.21
IUPAC Name4-hydroxy-3-methoxybenzamide;nonane
SMILESCCCCCCCCC.COc1cc(C(N)=O)ccc1O
InChIInChI=1S/C9H20.C8H9NO3/c1-3-5-7-9-8-6-4-2;1-12-7-4-5(8(9)11)2-3-6(7)10/h3-9H2,1-2H3;2-4,10H,1H3,(H2,9,11)
InChIKeyVQMVCIIOQHEVQJ-UHFFFAOYSA-N
XLogP4.26
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.42
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-methoxy-3-pentoxybenzamide
CID 82041442
N-hexyl-4-hydroxy-3-methoxybenzamide
CID 177108145
4-butoxy-3-methoxybenzamide
CID 47102628
1-(4-hydroxy-3-methoxyphenyl)nonadec-10-en-1-one
CID 68578323
3-(4-hydroxy-3-methoxybenzoyl)oxypropyl 4-hydroxy-3-methoxybenzoate
CID 45376005
3-amino-4-hexoxybenzamide
CID 43448578
3-amino-4-octoxybenzamide
CID 43448577
1,3-bis(4-hydroxy-3-methoxyphenyl)propane-1,3-dione
CID 143339753
3-chloro-4-dodecoxybenzamide
CID 172740881
(4-hydroxy-3-methoxyphenyl)methyl tridecanoate
CID 25120035
(4-hydroxy-3-methoxyphenyl)methyl undecanoate
CID 15979965
2-[(4-hydroxy-3-methoxyphenyl)methyl]decanamide
CID 68625712

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-methoxybenzamide;nonane?
The IUPAC name of 4-hydroxy-3-methoxybenzamide;nonane (CID 174831625) is 4-hydroxy-3-methoxybenzamide;nonane.
What is the SMILES notation for 4-hydroxy-3-methoxybenzamide;nonane?
The canonical SMILES for 4-hydroxy-3-methoxybenzamide;nonane is CCCCCCCCC.COc1cc(C(N)=O)ccc1O.
What is the InChIKey of 4-hydroxy-3-methoxybenzamide;nonane?
The InChIKey is VQMVCIIOQHEVQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20.C8H9NO3/c1-3-5-7-9-8-6-4-2;1-12-7-4-5(8(9)11)2-3-6(7)10/h3-9H2,1-2H3;2-4,10H,1H3,(H2,9,11).
What are the key properties of 4-hydroxy-3-methoxybenzamide;nonane?
4-hydroxy-3-methoxybenzamide;nonane has a molecular weight of 295.42 g/mol, XLogP of 4.26, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-methoxybenzamide;nonane is sourced from PubChem (CID 174831625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).