2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide

C18H27ClN2O2 — CID 75689586

IUPAC2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide
SMILESCCC(CC)C(CNC(=O)c1ccccc1Cl)N1CCOCC1
InChIInChI=1S/C18H27ClN2O2/c1-3-14(4-2)17(21-9-11-23-12-10-21)13-20-18(22)15-7-5-6-8-16(15)19/h5-8,14,17H,3-4,9-13H2,1-2H3,(H,20,22)
InChIKeyXKAVOTVDKQRLEX-UHFFFAOYSA-N
MW338.88 g/mol
LogP3.21
Rot. Bonds7

About 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide

2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide (PubChem CID 75689586) has the molecular formula C18H27ClN2O2 and a molecular weight of 338.88 g/mol. Its IUPAC name is 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide
PubChem CID75689586
Molecular FormulaC18H27ClN2O2
Molecular Weight338.88 g/mol
Exact Mass338.18
IUPAC Name2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide
SMILESCCC(CC)C(CNC(=O)c1ccccc1Cl)N1CCOCC1
InChIInChI=1S/C18H27ClN2O2/c1-3-14(4-2)17(21-9-11-23-12-10-21)13-20-18(22)15-7-5-6-8-16(15)19/h5-8,14,17H,3-4,9-13H2,1-2H3,(H,20,22)
InChIKeyXKAVOTVDKQRLEX-UHFFFAOYSA-N
XLogP3.21
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.88
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide
CID 43046378
2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)-5-methylsulfanylbenzamide
CID 42943243
N-(3-ethyl-2-morpholin-4-ylpentyl)-2,3-dimethoxybenzamide
CID 46529390
3-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)-1-methylindole-2-carboxamide
CID 55665915
1-benzyl-N-(3-ethyl-2-morpholin-4-ylpentyl)pyrrole-2-carboxamide
CID 55585125
2-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)benzamide
CID 110402733
2-chloro-N-(2-methyl-3-morpholin-4-ylpropyl)benzamide
CID 110441973
N-(3-ethyl-2-morpholin-4-ylpentyl)-4-phenylpiperazine-1-carboxamide
CID 42954539
N-(3-ethyl-2-morpholin-4-ylpentyl)-1-oxidopyridin-1-ium-3-carboxamide
CID 43046384
3-chloro-N-[2-[(3-ethyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
CID 55550745
2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)quinoline-6-carboxamide
CID 55731335
2-amino-N-(3-ethyl-2-morpholin-4-ylpentyl)-2-phenylpropanamide
CID 120595092

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide?
The IUPAC name of 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide (CID 75689586) is 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide.
What is the SMILES notation for 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide?
The canonical SMILES for 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide is CCC(CC)C(CNC(=O)c1ccccc1Cl)N1CCOCC1.
What is the InChIKey of 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide?
The InChIKey is XKAVOTVDKQRLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27ClN2O2/c1-3-14(4-2)17(21-9-11-23-12-10-21)13-20-18(22)15-7-5-6-8-16(15)19/h5-8,14,17H,3-4,9-13H2,1-2H3,(H,20,22).
What are the key properties of 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide?
2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide has a molecular weight of 338.88 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide is sourced from PubChem (CID 75689586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).