5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide

C16H18ClN3O — CID 62171740

IUPAC5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)NCCc1ccccn1
InChIInChI=1S/C16H18ClN3O/c1-2-18-15-7-6-12(17)11-14(15)16(21)20-10-8-13-5-3-4-9-19-13/h3-7,9,11,18H,2,8,10H2,1H3,(H,20,21)
InChIKeyGSCUHIISNZAOJH-UHFFFAOYSA-N
MW303.79 g/mol
LogP3.14
Rot. Bonds6

About 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide

5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide (PubChem CID 62171740) has the molecular formula C16H18ClN3O and a molecular weight of 303.79 g/mol. Its IUPAC name is 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide
PubChem CID62171740
Molecular FormulaC16H18ClN3O
Molecular Weight303.79 g/mol
Exact Mass303.11
IUPAC Name5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)NCCc1ccccn1
InChIInChI=1S/C16H18ClN3O/c1-2-18-15-7-6-12(17)11-14(15)16(21)20-10-8-13-5-3-4-9-19-13/h3-7,9,11,18H,2,8,10H2,1H3,(H,20,21)
InChIKeyGSCUHIISNZAOJH-UHFFFAOYSA-N
XLogP3.14
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.79
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-hydrazinyl-N-(2-pyridin-2-ylethyl)benzamide
CID 62236376
5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 114921592
2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 62173151
4-[2-[[5-chloro-2-(ethylamino)benzoyl]amino]ethyl]benzoic acid
CID 70530914
2-(2-ethylphenyl)-N-(2-pyridin-2-ylethyl)benzamide
CID 142054987
5-chloro-2-(ethylamino)-N-[3-(1H-1,2,4-triazol-5-yl)propyl]benzamide
CID 64523585
4-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide
CID 62172971
2-(ethylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 62167465
2,5-dichloro-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 114917187
2-chloro-5-methylsulfanyl-N-(2-pyridin-2-ylethyl)benzamide
CID 4783071
2,4-difluoro-N-(2-pyridin-2-ylethyl)benzamide
CID 51164132
2-(2-pyridin-2-ylethylcarbamoyl)benzoic acid
CID 43396615

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide?
The IUPAC name of 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide (CID 62171740) is 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide.
What is the SMILES notation for 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide?
The canonical SMILES for 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide is CCNc1ccc(Cl)cc1C(=O)NCCc1ccccn1.
What is the InChIKey of 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide?
The InChIKey is GSCUHIISNZAOJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O/c1-2-18-15-7-6-12(17)11-14(15)16(21)20-10-8-13-5-3-4-9-19-13/h3-7,9,11,18H,2,8,10H2,1H3,(H,20,21).
What are the key properties of 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide?
5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide has a molecular weight of 303.79 g/mol, XLogP of 3.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(ethylamino)-N-(2-pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 62171740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).