3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide

C10H12Cl2N2O2 — CID 106170892

IUPAC3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide
SMILESNC(=O)C(O)CNCc1c(Cl)cccc1Cl
InChIInChI=1S/C10H12Cl2N2O2/c11-7-2-1-3-8(12)6(7)4-14-5-9(15)10(13)16/h1-3,9,14-15H,4-5H2,(H2,13,16)
InChIKeyHCOSBPORQMKEDB-UHFFFAOYSA-N
MW263.12 g/mol
LogP0.93
Rot. Bonds5

About 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide

3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide (PubChem CID 106170892) has the molecular formula C10H12Cl2N2O2 and a molecular weight of 263.12 g/mol. Its IUPAC name is 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide
PubChem CID106170892
Molecular FormulaC10H12Cl2N2O2
Molecular Weight263.12 g/mol
Exact Mass262.03
IUPAC Name3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide
SMILESNC(=O)C(O)CNCc1c(Cl)cccc1Cl
InChIInChI=1S/C10H12Cl2N2O2/c11-7-2-1-3-8(12)6(7)4-14-5-9(15)10(13)16/h1-3,9,14-15H,4-5H2,(H2,13,16)
InChIKeyHCOSBPORQMKEDB-UHFFFAOYSA-N
XLogP0.93
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.12
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-3-[(2,6-dichlorophenyl)methylamino]propane-1,2-diol
CID 96921213
3-[(4-chloro-2-fluorophenyl)methylamino]-2-hydroxypropanamide
CID 106171926
3-[[2-(2-chlorophenyl)acetyl]amino]-2-hydroxypropanamide
CID 107261274
2-hydroxy-3-[(3-hydroxyphenyl)methylamino]propanamide
CID 106170564
2-amino-3-[(2-chloro-6-methoxyphenyl)methylamino]propanamide
CID 103292977
(2R)-2-[[(2,6-dichlorophenyl)methylamino]methyl]-3-(4-fluorophenyl)propanamide
CID 97076543
6-[[(3-amino-2-hydroxy-3-oxopropyl)amino]methyl]pyridine-2-carboxylic acid
CID 106178072
1-[(2,6-dichlorophenyl)methylamino]-3-methylbutan-2-ol
CID 115630633
3-[[(3-amino-2-hydroxy-3-oxopropyl)amino]methyl]benzamide
CID 114153512
4-[(2,6-dichlorophenyl)methylamino]-3-methylbutan-1-ol
CID 66089888
3-[(4-chloro-2-methylphenyl)methylamino]-2-hydroxypropanamide
CID 106172166
2-hydroxy-3-[(1-methylpyrrol-2-yl)methylamino]propanamide
CID 106171308

Frequently Asked Questions

What is the IUPAC name of 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide?
The IUPAC name of 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide (CID 106170892) is 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide.
What is the SMILES notation for 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide?
The canonical SMILES for 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide is NC(=O)C(O)CNCc1c(Cl)cccc1Cl.
What is the InChIKey of 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide?
The InChIKey is HCOSBPORQMKEDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2O2/c11-7-2-1-3-8(12)6(7)4-14-5-9(15)10(13)16/h1-3,9,14-15H,4-5H2,(H2,13,16).
What are the key properties of 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide?
3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide has a molecular weight of 263.12 g/mol, XLogP of 0.93, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,6-dichlorophenyl)methylamino]-2-hydroxypropanamide is sourced from PubChem (CID 106170892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).