5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide

C14H19ClFNO3 — CID 61074145

IUPAC5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
SMILESCOCCCN(CCOC)C(=O)c1cc(Cl)ccc1F
InChIInChI=1S/C14H19ClFNO3/c1-19-8-3-6-17(7-9-20-2)14(18)12-10-11(15)4-5-13(12)16/h4-5,10H,3,6-9H2,1-2H3
InChIKeyNFUKFUOIIVMQTM-UHFFFAOYSA-N
MW303.76 g/mol
LogP2.60
Rot. Bonds8

About 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide

5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide (PubChem CID 61074145) has the molecular formula C14H19ClFNO3 and a molecular weight of 303.76 g/mol. Its IUPAC name is 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
PubChem CID61074145
Molecular FormulaC14H19ClFNO3
Molecular Weight303.76 g/mol
Exact Mass303.10
IUPAC Name5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
SMILESCOCCCN(CCOC)C(=O)c1cc(Cl)ccc1F
InChIInChI=1S/C14H19ClFNO3/c1-19-8-3-6-17(7-9-20-2)14(18)12-10-11(15)4-5-13(12)16/h4-5,10H,3,6-9H2,1-2H3
InChIKeyNFUKFUOIIVMQTM-UHFFFAOYSA-N
XLogP2.60
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.76
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-2-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 62247658
2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 54915998
5-chloro-N-(2-chloroethyl)-2-iodo-N-(2-methoxyethyl)benzamide
CID 114029716
5-chloro-2-fluoro-N,N-bis(2-hydroxyethyl)benzamide
CID 61145588
3,4,5-trifluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 63188742
N-ethyl-2-fluoro-N-(2-methoxyethyl)-5-methylbenzamide
CID 62512852
N-(3-aminopropyl)-2-fluoro-N-(2-methoxyethyl)benzamide
CID 55173242
methyl 3-[(2,5-difluorobenzoyl)-(2-methoxyethyl)amino]propanoate
CID 78958878
5-chloro-2-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)benzamide
CID 113468065
2,5-dihydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 103892150
N-(3-amino-3-sulfanylidenepropyl)-2,5-difluoro-N-(2-methoxyethyl)benzamide
CID 63287621
5-amino-2,4-difluoro-N,N-bis(2-methoxyethyl)benzamide
CID 61095461

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide?
The IUPAC name of 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide (CID 61074145) is 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide.
What is the SMILES notation for 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide?
The canonical SMILES for 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide is COCCCN(CCOC)C(=O)c1cc(Cl)ccc1F.
What is the InChIKey of 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide?
The InChIKey is NFUKFUOIIVMQTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClFNO3/c1-19-8-3-6-17(7-9-20-2)14(18)12-10-11(15)4-5-13(12)16/h4-5,10H,3,6-9H2,1-2H3.
What are the key properties of 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide?
5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide has a molecular weight of 303.76 g/mol, XLogP of 2.60, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide is sourced from PubChem (CID 61074145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).