N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide

C17H19ClN2O — CID 43095855

IUPACN-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide
SMILESCCC(Nc1cccc(NC(C)=O)c1)c1ccc(Cl)cc1
InChIInChI=1S/C17H19ClN2O/c1-3-17(13-7-9-14(18)10-8-13)20-16-6-4-5-15(11-16)19-12(2)21/h4-11,17,20H,3H2,1-2H3,(H,19,21)
InChIKeyCEIKWUIJRMZTGW-UHFFFAOYSA-N
MW302.81 g/mol
LogP4.86
Rot. Bonds5

About N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide

N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide (PubChem CID 43095855) has the molecular formula C17H19ClN2O and a molecular weight of 302.81 g/mol. Its IUPAC name is N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide
PubChem CID43095855
Molecular FormulaC17H19ClN2O
Molecular Weight302.81 g/mol
Exact Mass302.12
IUPAC NameN-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide
SMILESCCC(Nc1cccc(NC(C)=O)c1)c1ccc(Cl)cc1
InChIInChI=1S/C17H19ClN2O/c1-3-17(13-7-9-14(18)10-8-13)20-16-6-4-5-15(11-16)19-12(2)21/h4-11,17,20H,3H2,1-2H3,(H,19,21)
InChIKeyCEIKWUIJRMZTGW-UHFFFAOYSA-N
XLogP4.86
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.81
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[1-[1-(4-chlorophenyl)propylamino]ethyl]phenyl]acetamide
CID 119139033
N-[3-[1-(4-fluorophenyl)propylamino]phenyl]-2-hydroxyacetamide
CID 56794102
[4-[1-(4-chlorophenyl)propylamino]phenyl]urea
CID 43745000
N-[3-[1-(3-chlorophenyl)propylamino]phenyl]cyclopropanecarboxamide
CID 112815872
N-[3-[(3-methyl-1-phenylbutyl)amino]phenyl]acetamide
CID 43824801
N-(3-acetamidophenyl)-2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]acetamide
CID 32705841
N-[3-(3-methylpentan-2-ylamino)phenyl]acetamide
CID 43201157
3-chloro-N-[1-(4-chlorophenyl)propyl]-4-fluoroaniline
CID 43119213
2-(4-acetamidophenyl)-N-[(1R)-1-(4-chlorophenyl)propyl]acetamide
CID 42138957
N-[4-[[(1S)-1-(4-chlorophenyl)-2-methoxyethyl]amino]phenyl]acetamide
CID 99840683
[3-[1-(4-chlorophenyl)ethylamino]phenyl]urea
CID 43744548
N-[3-[(4-chlorophenyl)carbamothioylamino]phenyl]acetamide
CID 3608346

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide?
The IUPAC name of N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide (CID 43095855) is N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide.
What is the SMILES notation for N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide?
The canonical SMILES for N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide is CCC(Nc1cccc(NC(C)=O)c1)c1ccc(Cl)cc1.
What is the InChIKey of N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide?
The InChIKey is CEIKWUIJRMZTGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O/c1-3-17(13-7-9-14(18)10-8-13)20-16-6-4-5-15(11-16)19-12(2)21/h4-11,17,20H,3H2,1-2H3,(H,19,21).
What are the key properties of N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide?
N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide has a molecular weight of 302.81 g/mol, XLogP of 4.86, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-(4-chlorophenyl)propylamino]phenyl]acetamide is sourced from PubChem (CID 43095855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).