N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide

C14H21ClN2O2 — CID 60774874

IUPACN-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
SMILESCCCN(CCO)CCC(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H21ClN2O2/c1-2-8-17(10-11-18)9-7-14(19)16-13-6-4-3-5-12(13)15/h3-6,18H,2,7-11H2,1H3,(H,16,19)
InChIKeyAIYZHYWJQKNCRE-UHFFFAOYSA-N
MW284.79 g/mol
LogP2.37
Rot. Bonds8

About N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide

N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide (PubChem CID 60774874) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
PubChem CID60774874
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC NameN-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
SMILESCCCN(CCO)CCC(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H21ClN2O2/c1-2-8-17(10-11-18)9-7-14(19)16-13-6-4-3-5-12(13)15/h3-6,18H,2,7-11H2,1H3,(H,16,19)
InChIKeyAIYZHYWJQKNCRE-UHFFFAOYSA-N
XLogP2.37
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[benzyl(2-hydroxyethyl)amino]-N-(2-chlorophenyl)propanamide
CID 3787915
3-[2-hydroxyethyl(propyl)amino]-N-phenylpropanamide
CID 62016603
N-(2-chlorophenyl)-3-[2-hydroxyethyl(propan-2-yl)amino]propanamide
CID 62021726
N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide
CID 52579958
N-(2-chlorophenyl)-3-[ethyl(2-methylprop-2-enyl)amino]propanamide;hydrochloride
CID 90483718
N-(2-chlorophenyl)hexanamide
CID 4644560
3-[acetyl(butyl)amino]-N-(2-chlorophenyl)propanamide
CID 113115826
3-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(2-chlorophenyl)propanamide
CID 79664559
N-(2-chlorophenyl)octanamide
CID 2292983
3-(dipropylamino)-N-phenylpropanamide
CID 52579960
N-(2-chlorophenyl)-2-(dibutylamino)acetamide
CID 18870799
methyl 3-[[3-(2-chloroanilino)-3-oxopropyl]-methylamino]propanoate
CID 62012452

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide?
The IUPAC name of N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide (CID 60774874) is N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide?
The canonical SMILES for N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide is CCCN(CCO)CCC(=O)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide?
The InChIKey is AIYZHYWJQKNCRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O2/c1-2-8-17(10-11-18)9-7-14(19)16-13-6-4-3-5-12(13)15/h3-6,18H,2,7-11H2,1H3,(H,16,19).
What are the key properties of N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide?
N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide has a molecular weight of 284.79 g/mol, XLogP of 2.37, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide is sourced from PubChem (CID 60774874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).