N,N-dimethyl-5-(3-propylphenoxy)pentanamide

C16H25NO2 — CID 173258398

IUPACN,N-dimethyl-5-(3-propylphenoxy)pentanamide
SMILESCCCc1cccc(OCCCCC(=O)N(C)C)c1
InChIInChI=1S/C16H25NO2/c1-4-8-14-9-7-10-15(13-14)19-12-6-5-11-16(18)17(2)3/h7,9-10,13H,4-6,8,11-12H2,1-3H3
InChIKeyBZTUNITYDWOIQK-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.28
Rot. Bonds8

About N,N-dimethyl-5-(3-propylphenoxy)pentanamide

N,N-dimethyl-5-(3-propylphenoxy)pentanamide (PubChem CID 173258398) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N,N-dimethyl-5-(3-propylphenoxy)pentanamide.

Molecular Properties

Compound NameN,N-dimethyl-5-(3-propylphenoxy)pentanamide
PubChem CID173258398
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN,N-dimethyl-5-(3-propylphenoxy)pentanamide
SMILESCCCc1cccc(OCCCCC(=O)N(C)C)c1
InChIInChI=1S/C16H25NO2/c1-4-8-14-9-7-10-15(13-14)19-12-6-5-11-16(18)17(2)3/h7,9-10,13H,4-6,8,11-12H2,1-3H3
InChIKeyBZTUNITYDWOIQK-UHFFFAOYSA-N
XLogP3.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-5-(3-propylphenoxy)pentanamide
CID 173258739
5-(3-propylphenoxy)pentan-1-ol
CID 174619714
N,N-dimethyl-6-phenoxyhexanamide
CID 142596913
7-(3-propoxyphenyl)heptan-3-one
CID 157062342
ethane;6-(3-propoxyphenyl)hexan-2-one
CID 157048681
N,N-dimethyl-3-(3-methylphenoxy)propanamide
CID 60637097
4-(3-pentadecylphenoxy)butanamide
CID 22354511
2-(3-octoxyphenyl)ethanol
CID 141227544
(3-propoxyphenyl)-(3-propylphenyl)methanone
CID 115812256
N-[3-[3-(dimethylamino)-3-oxopropyl]phenyl]-4-heptoxybenzamide
CID 43912146
methyl 5-[3-(3-hydroxypropyl)phenoxy]pentanoate
CID 10400711
3-[3-[(2-methoxyethylamino)methyl]phenoxy]-N,N-dimethylpropanamide
CID 63057423

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-(3-propylphenoxy)pentanamide?
The IUPAC name of N,N-dimethyl-5-(3-propylphenoxy)pentanamide (CID 173258398) is N,N-dimethyl-5-(3-propylphenoxy)pentanamide.
What is the SMILES notation for N,N-dimethyl-5-(3-propylphenoxy)pentanamide?
The canonical SMILES for N,N-dimethyl-5-(3-propylphenoxy)pentanamide is CCCc1cccc(OCCCCC(=O)N(C)C)c1.
What is the InChIKey of N,N-dimethyl-5-(3-propylphenoxy)pentanamide?
The InChIKey is BZTUNITYDWOIQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-8-14-9-7-10-15(13-14)19-12-6-5-11-16(18)17(2)3/h7,9-10,13H,4-6,8,11-12H2,1-3H3.
What are the key properties of N,N-dimethyl-5-(3-propylphenoxy)pentanamide?
N,N-dimethyl-5-(3-propylphenoxy)pentanamide has a molecular weight of 263.38 g/mol, XLogP of 3.28, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-(3-propylphenoxy)pentanamide is sourced from PubChem (CID 173258398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).