(3R)-3-(2-hydroxyphenyl)-N-propylpentanamide

C14H21NO2 — CID 134964830

IUPAC(3R)-3-(2-hydroxyphenyl)-N-propylpentanamide
SMILESCCCNC(=O)C[C@@H](CC)c1ccccc1O
InChIInChI=1S/C14H21NO2/c1-3-9-15-14(17)10-11(4-2)12-7-5-6-8-13(12)16/h5-8,11,16H,3-4,9-10H2,1-2H3,(H,15,17)/t11-/m1/s1
InChIKeyLEOGDBAVQPAEBD-LLVKDONJSA-N
MW235.33 g/mol
LogP2.80
Rot. Bonds6

About (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide

(3R)-3-(2-hydroxyphenyl)-N-propylpentanamide (PubChem CID 134964830) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide.

Molecular Properties

Compound Name(3R)-3-(2-hydroxyphenyl)-N-propylpentanamide
PubChem CID134964830
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name(3R)-3-(2-hydroxyphenyl)-N-propylpentanamide
SMILESCCCNC(=O)C[C@@H](CC)c1ccccc1O
InChIInChI=1S/C14H21NO2/c1-3-9-15-14(17)10-11(4-2)12-7-5-6-8-13(12)16/h5-8,11,16H,3-4,9-10H2,1-2H3,(H,15,17)/t11-/m1/s1
InChIKeyLEOGDBAVQPAEBD-LLVKDONJSA-N
XLogP2.80
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide?
The IUPAC name of (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide (CID 134964830) is (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide.
What is the SMILES notation for (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide?
The canonical SMILES for (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide is CCCNC(=O)C[C@@H](CC)c1ccccc1O.
What is the InChIKey of (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide?
The InChIKey is LEOGDBAVQPAEBD-LLVKDONJSA-N. The full InChI is InChI=1S/C14H21NO2/c1-3-9-15-14(17)10-11(4-2)12-7-5-6-8-13(12)16/h5-8,11,16H,3-4,9-10H2,1-2H3,(H,15,17)/t11-/m1/s1.
What are the key properties of (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide?
(3R)-3-(2-hydroxyphenyl)-N-propylpentanamide has a molecular weight of 235.33 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(2-hydroxyphenyl)-N-propylpentanamide is sourced from PubChem (CID 134964830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).