N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide

C12H17Cl2N3O2 — CID 55028442

IUPACN-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
SMILESCCCN(CCO)CC(=O)Nc1ncc(Cl)cc1Cl
InChIInChI=1S/C12H17Cl2N3O2/c1-2-3-17(4-5-18)8-11(19)16-12-10(14)6-9(13)7-15-12/h6-7,18H,2-5,8H2,1H3,(H,15,16,19)
InChIKeyGVEFZPGWFINZAC-UHFFFAOYSA-N
MW306.19 g/mol
LogP2.03
Rot. Bonds7

About N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide

N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide (PubChem CID 55028442) has the molecular formula C12H17Cl2N3O2 and a molecular weight of 306.19 g/mol. Its IUPAC name is N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide.

Molecular Properties

Compound NameN-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
PubChem CID55028442
Molecular FormulaC12H17Cl2N3O2
Molecular Weight306.19 g/mol
Exact Mass305.07
IUPAC NameN-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
SMILESCCCN(CCO)CC(=O)Nc1ncc(Cl)cc1Cl
InChIInChI=1S/C12H17Cl2N3O2/c1-2-3-17(4-5-18)8-11(19)16-12-10(14)6-9(13)7-15-12/h6-7,18H,2-5,8H2,1H3,(H,15,16,19)
InChIKeyGVEFZPGWFINZAC-UHFFFAOYSA-N
XLogP2.03
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.19
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 110881682
2-[bis(2-hydroxyethyl)amino]-N-(2,4-dichlorophenyl)acetamide
CID 18870879
2-[[2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl]amino]pentanoic acid
CID 43631726
S-methyl N-(3,5-dichloro-2-pyridinyl)carbamothioate
CID 87838372
N-(4-aminophenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 61425121
2-[[2-oxo-2-(2,4,6-trichloroanilino)ethyl]-propylamino]-N-propylacetamide
CID 87018436
2-[2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl]sulfanyl-3-methylbutanoic acid
CID 105353727
2-[butyl(2-hydroxyethyl)amino]-N-(3-chloro-4-cyanophenyl)acetamide
CID 60689275
[2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl]-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
CID 8785754
N-(3-bromophenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60692729
2-chloro-N-(3,5-dichloro-2-pyridinyl)propanamide
CID 4583439
[2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium
CID 8620722

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The IUPAC name of N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide (CID 55028442) is N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide.
What is the SMILES notation for N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The canonical SMILES for N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide is CCCN(CCO)CC(=O)Nc1ncc(Cl)cc1Cl.
What is the InChIKey of N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The InChIKey is GVEFZPGWFINZAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17Cl2N3O2/c1-2-3-17(4-5-18)8-11(19)16-12-10(14)6-9(13)7-15-12/h6-7,18H,2-5,8H2,1H3,(H,15,16,19).
What are the key properties of N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide has a molecular weight of 306.19 g/mol, XLogP of 2.03, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-2-pyridinyl)-2-[2-hydroxyethyl(propyl)amino]acetamide is sourced from PubChem (CID 55028442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).