2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide

C18H18ClN3O2 — CID 75435791

IUPAC2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(Cc1c[nH]c2ccc(Cl)cc12)N(CCO)Cc1cccnc1
InChIInChI=1S/C18H18ClN3O2/c19-15-3-4-17-16(9-15)14(11-21-17)8-18(24)22(6-7-23)12-13-2-1-5-20-10-13/h1-5,9-11,21,23H,6-8,12H2
InChIKeyUTSWCKZNEBWUCW-UHFFFAOYSA-N
MW343.81 g/mol
LogP2.78
Rot. Bonds6

About 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide

2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 75435791) has the molecular formula C18H18ClN3O2 and a molecular weight of 343.81 g/mol. Its IUPAC name is 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide
PubChem CID75435791
Molecular FormulaC18H18ClN3O2
Molecular Weight343.81 g/mol
Exact Mass343.11
IUPAC Name2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(Cc1c[nH]c2ccc(Cl)cc12)N(CCO)Cc1cccnc1
InChIInChI=1S/C18H18ClN3O2/c19-15-3-4-17-16(9-15)14(11-21-17)8-18(24)22(6-7-23)12-13-2-1-5-20-10-13/h1-5,9-11,21,23H,6-8,12H2
InChIKeyUTSWCKZNEBWUCW-UHFFFAOYSA-N
XLogP2.78
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.81
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-N-(2-hydroxyethyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 110890145
N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide
CID 62689181
N-[(2,4-dichlorophenyl)methyl]-2-phenyl-N-(pyridin-3-ylmethyl)acetamide
CID 168853808
2-(5-chloro-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 110411692
2-(5-chloro-1H-indol-3-yl)-2-oxo-N-(pyridin-3-ylmethyl)acetamide
CID 113208230
N-cyclopropyl-2-(1H-indol-3-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 46124380
N-(1,3-benzodioxol-5-yl)-2-(1H-indol-3-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 8850570
2-(6-chloro-1H-indol-3-yl)-2-oxo-N-(pyridin-3-ylmethyl)acetamide
CID 113208767
N-[2-[acetyl(pyridin-3-ylmethyl)amino]ethyl]-2-(1H-indol-3-yl)acetamide
CID 113055312
3-chloro-N-(2-hydroxyethyl)-5-nitro-N-(pyridin-3-ylmethyl)benzamide
CID 75435792
N-butyl-2-(5-chloro-1H-indol-3-yl)-N-methylacetamide
CID 110415872
2-(5-chloro-1H-indol-3-yl)acetate
CID 21122976

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide (CID 75435791) is 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide is O=C(Cc1c[nH]c2ccc(Cl)cc12)N(CCO)Cc1cccnc1.
What is the InChIKey of 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is UTSWCKZNEBWUCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O2/c19-15-3-4-17-16(9-15)14(11-21-17)8-18(24)22(6-7-23)12-13-2-1-5-20-10-13/h1-5,9-11,21,23H,6-8,12H2.
What are the key properties of 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide?
2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 343.81 g/mol, XLogP of 2.78, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 75435791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).