N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide

C15H23NO2 — CID 110781781

IUPACN-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide
SMILESCCCCC(=O)NCc1cc(CC)ccc1OC
InChIInChI=1S/C15H23NO2/c1-4-6-7-15(17)16-11-13-10-12(5-2)8-9-14(13)18-3/h8-10H,4-7,11H2,1-3H3,(H,16,17)
InChIKeyLZWDQXNQQAZTCT-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.06
Rot. Bonds7

About N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide

N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide (PubChem CID 110781781) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide.

Molecular Properties

Compound NameN-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide
PubChem CID110781781
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide
SMILESCCCCC(=O)NCc1cc(CC)ccc1OC
InChIInChI=1S/C15H23NO2/c1-4-6-7-15(17)16-11-13-10-12(5-2)8-9-14(13)18-3/h8-10H,4-7,11H2,1-3H3,(H,16,17)
InChIKeyLZWDQXNQQAZTCT-UHFFFAOYSA-N
XLogP3.06
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(5-ethyl-2-methoxyphenyl)methyl]-2-(methylamino)acetamide
CID 98784014
2-(cyclopropylamino)-N-[(5-ethyl-2-methoxyphenyl)methyl]acetamide
CID 115158448
1-[(5-ethyl-2-methoxyphenyl)methyl]-3-propan-2-ylurea
CID 110775027
N-(cyanomethyl)-2-(5-ethyl-2-methoxyphenyl)acetamide
CID 96660374
N-[(4-methoxyphenyl)methyl]pentanamide
CID 2169969
5-[(5-fluoro-2-methoxyphenyl)methylamino]-5-oxopentanoic acid
CID 94696058
N-[(2,5-dimethoxyphenyl)methyl]-4-(methylamino)butanamide
CID 61252269
N-[(5-amino-2-methoxyphenyl)methyl]-3-propoxypropanamide
CID 62688423
N-[(4-hydroxy-3-methoxyphenyl)methyl]nonanamide
CID 2998
N-[(2-chloro-4,5-dimethoxyphenyl)methyl]hexanamide
CID 54785381
3-(3,4-dimethoxyphenyl)-N-[(2,5-dimethoxyphenyl)methyl]propanamide
CID 33109851
N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide
CID 110787710

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide?
The IUPAC name of N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide (CID 110781781) is N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide.
What is the SMILES notation for N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide?
The canonical SMILES for N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide is CCCCC(=O)NCc1cc(CC)ccc1OC.
What is the InChIKey of N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide?
The InChIKey is LZWDQXNQQAZTCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-4-6-7-15(17)16-11-13-10-12(5-2)8-9-14(13)18-3/h8-10H,4-7,11H2,1-3H3,(H,16,17).
What are the key properties of N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide?
N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide has a molecular weight of 249.35 g/mol, XLogP of 3.06, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-2-methoxyphenyl)methyl]pentanamide is sourced from PubChem (CID 110781781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).