N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide

C13H19ClN2O2 — CID 103820250

IUPACN-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide
SMILESO=C(CNCCCCCO)Nc1cccc(Cl)c1
InChIInChI=1S/C13H19ClN2O2/c14-11-5-4-6-12(9-11)16-13(18)10-15-7-2-1-3-8-17/h4-6,9,15,17H,1-3,7-8,10H2,(H,16,18)
InChIKeySHLDPPFETUFTQA-UHFFFAOYSA-N
MW270.76 g/mol
LogP2.03
Rot. Bonds8

About N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide

N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide (PubChem CID 103820250) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide
PubChem CID103820250
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC NameN-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide
SMILESO=C(CNCCCCCO)Nc1cccc(Cl)c1
InChIInChI=1S/C13H19ClN2O2/c14-11-5-4-6-12(9-11)16-13(18)10-15-7-2-1-3-8-17/h4-6,9,15,17H,1-3,7-8,10H2,(H,16,18)
InChIKeySHLDPPFETUFTQA-UHFFFAOYSA-N
XLogP2.03
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 52.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-chlorophenyl)-2-(hexadecylamino)acetamide
CID 54809142
N-(3-chlorophenyl)-2-(octylamino)acetamide
CID 78914396
N-(3-chlorophenyl)-2-[3-(dimethylamino)propylamino]acetamide
CID 28583672
2-(4-hydroxybutylamino)-N-(3-methylphenyl)acetamide
CID 103820281
N-(3-fluorophenyl)-2-(4-hydroxybutylamino)acetamide
CID 113268571
N-(3-chlorophenyl)-2-[3-(methanesulfonamido)propylamino]acetamide
CID 103820258
N-(3-chlorophenyl)-2-(2-methoxyethylamino)acetamide
CID 28565603
N-(3-chlorophenyl)-2-(pent-3-ynylamino)acetamide
CID 116643821
N-(3-chlorophenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 55023239
N-(3-chlorophenyl)-2-(2,3-dihydroxypropylamino)acetamide
CID 66171426
N-(3-chlorophenyl)-2-(2,2-dimethylpropylamino)acetamide
CID 61168620
N,N'-bis(3-chlorophenyl)pentanediamide
CID 1011389

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide (CID 103820250) is N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide is O=C(CNCCCCCO)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide?
The InChIKey is SHLDPPFETUFTQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c14-11-5-4-6-12(9-11)16-13(18)10-15-7-2-1-3-8-17/h4-6,9,15,17H,1-3,7-8,10H2,(H,16,18).
What are the key properties of N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide?
N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide has a molecular weight of 270.76 g/mol, XLogP of 2.03, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(5-hydroxypentylamino)acetamide is sourced from PubChem (CID 103820250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).