2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide

C16H24N2O3 — CID 32976806

IUPAC2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide
SMILESCCCCCNC(=O)c1ccccc1OCC(=O)N(C)C
InChIInChI=1S/C16H24N2O3/c1-4-5-8-11-17-16(20)13-9-6-7-10-14(13)21-12-15(19)18(2)3/h6-7,9-10H,4-5,8,11-12H2,1-3H3,(H,17,20)
InChIKeyKYFMTTXFKVVIKP-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.07
Rot. Bonds8

About 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide

2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide (PubChem CID 32976806) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide
PubChem CID32976806
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide
SMILESCCCCCNC(=O)c1ccccc1OCC(=O)N(C)C
InChIInChI=1S/C16H24N2O3/c1-4-5-8-11-17-16(20)13-9-6-7-10-14(13)21-12-15(19)18(2)3/h6-7,9-10H,4-5,8,11-12H2,1-3H3,(H,17,20)
InChIKeyKYFMTTXFKVVIKP-UHFFFAOYSA-N
XLogP2.07
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-butoxy-N-[8-[(2-butoxybenzoyl)amino]octyl]benzamide
CID 17233378
2-(2-amino-2-oxoethoxy)-N-butylbenzamide
CID 36711020
2-methoxy-N-tridecylbenzamide
CID 139819873
N-(4-chlorobutyl)-2-ethoxybenzamide
CID 106845375
N-(6-aminohexyl)-2-dodecoxybenzamide
CID 10319064
2-ethoxy-N-(6-hydroxyhexyl)benzamide
CID 103919109
N-(2-aminoethyl)-2-hexoxybenzamide
CID 90319052
2-[2-(dimethylamino)-2-oxoethoxy]-N-(3-methyl-2-phenylbutyl)benzamide
CID 46447084
2-ethoxy-N-(2-hydroxyethyl)benzamide
CID 4088522
2-propoxy-N-propylbenzamide
CID 58831728
2-ethoxy-N-[2-(propylamino)ethyl]benzamide
CID 62658238
2-ethoxy-N-pent-4-ynylbenzamide
CID 103709030

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide?
The IUPAC name of 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide (CID 32976806) is 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide.
What is the SMILES notation for 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide?
The canonical SMILES for 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide is CCCCCNC(=O)c1ccccc1OCC(=O)N(C)C.
What is the InChIKey of 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide?
The InChIKey is KYFMTTXFKVVIKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-4-5-8-11-17-16(20)13-9-6-7-10-14(13)21-12-15(19)18(2)3/h6-7,9-10H,4-5,8,11-12H2,1-3H3,(H,17,20).
What are the key properties of 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide?
2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide has a molecular weight of 292.38 g/mol, XLogP of 2.07, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)-2-oxoethoxy]-N-pentylbenzamide is sourced from PubChem (CID 32976806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).