N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide

C15H22Cl2N2O — CID 52579958

IUPACN-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide
SMILESCCCN(CCC)CCC(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C15H22Cl2N2O/c1-3-8-19(9-4-2)10-7-15(20)18-14-11-12(16)5-6-13(14)17/h5-6,11H,3-4,7-10H2,1-2H3,(H,18,20)
InChIKeyFVMROFVOLQKQLT-UHFFFAOYSA-N
MW317.26 g/mol
LogP4.44
Rot. Bonds8

About N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide

N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide (PubChem CID 52579958) has the molecular formula C15H22Cl2N2O and a molecular weight of 317.26 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide
PubChem CID52579958
Molecular FormulaC15H22Cl2N2O
Molecular Weight317.26 g/mol
Exact Mass316.11
IUPAC NameN-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide
SMILESCCCN(CCC)CCC(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C15H22Cl2N2O/c1-3-8-19(9-4-2)10-7-15(20)18-14-11-12(16)5-6-13(14)17/h5-6,11H,3-4,7-10H2,1-2H3,(H,18,20)
InChIKeyFVMROFVOLQKQLT-UHFFFAOYSA-N
XLogP4.44
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.26
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dichlorophenyl)-3-[[2-(methylamino)-2-oxoethyl]-propylamino]propanamide
CID 56792887
2-[[3-(2,5-dichloroanilino)-3-oxopropyl]-ethylamino]acetic acid
CID 61012162
N-(2,5-dichlorophenyl)-3-[2-hydroxyethyl(3-hydroxypropyl)amino]propanamide
CID 111112511
N-(2,5-dichlorophenyl)hexanamide
CID 5055577
N-[4-chloro-2-(trifluoromethyl)phenyl]-3-(dipropylamino)propanamide
CID 109033185
3-[2-aminoethyl(methyl)amino]-N-(2,5-dichlorophenyl)propanamide
CID 55103947
N-(2,5-dichlorophenyl)heptanamide
CID 3294645
N-(4-chlorophenyl)-3-(dipropylamino)propanamide
CID 109033132
N-(2-chlorophenyl)-3-[2-hydroxyethyl(propyl)amino]propanamide
CID 60774874
N-(2,5-dichlorophenyl)-3-(N-methylanilino)propanamide
CID 51654070
N-(2,5-dichlorophenyl)-3-hydroxypropanamide
CID 43558723
3-[butan-2-yl(methylsulfonyl)amino]-N-(2,5-dichlorophenyl)propanamide
CID 113137172

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide?
The IUPAC name of N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide (CID 52579958) is N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide is CCCN(CCC)CCC(=O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide?
The InChIKey is FVMROFVOLQKQLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Cl2N2O/c1-3-8-19(9-4-2)10-7-15(20)18-14-11-12(16)5-6-13(14)17/h5-6,11H,3-4,7-10H2,1-2H3,(H,18,20).
What are the key properties of N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide?
N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide has a molecular weight of 317.26 g/mol, XLogP of 4.44, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide is sourced from PubChem (CID 52579958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).