N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide

C22H30N2O2 — CID 4878605

IUPACN-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide
SMILESCC(C)c1cccc(C(C)C)c1NC(=O)CNCC(O)c1ccccc1
InChIInChI=1S/C22H30N2O2/c1-15(2)18-11-8-12-19(16(3)4)22(18)24-21(26)14-23-13-20(25)17-9-6-5-7-10-17/h5-12,15-16,20,23,25H,13-14H2,1-4H3,(H,24,26)
InChIKeyLNZPRRDDFWZSLE-UHFFFAOYSA-N
MW354.49 g/mol
LogP4.20
Rot. Bonds8

About N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide

N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide (PubChem CID 4878605) has the molecular formula C22H30N2O2 and a molecular weight of 354.49 g/mol. Its IUPAC name is N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide.

Molecular Properties

Compound NameN-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide
PubChem CID4878605
Molecular FormulaC22H30N2O2
Molecular Weight354.49 g/mol
Exact Mass354.23
IUPAC NameN-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide
SMILESCC(C)c1cccc(C(C)C)c1NC(=O)CNCC(O)c1ccccc1
InChIInChI=1S/C22H30N2O2/c1-15(2)18-11-8-12-19(16(3)4)22(18)24-21(26)14-23-13-20(25)17-9-6-5-7-10-17/h5-12,15-16,20,23,25H,13-14H2,1-4H3,(H,24,26)
InChIKeyLNZPRRDDFWZSLE-UHFFFAOYSA-N
XLogP4.20
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.49
LogP ≤ 54.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide?
The IUPAC name of N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide (CID 4878605) is N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide.
What is the SMILES notation for N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide?
The canonical SMILES for N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide is CC(C)c1cccc(C(C)C)c1NC(=O)CNCC(O)c1ccccc1.
What is the InChIKey of N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide?
The InChIKey is LNZPRRDDFWZSLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O2/c1-15(2)18-11-8-12-19(16(3)4)22(18)24-21(26)14-23-13-20(25)17-9-6-5-7-10-17/h5-12,15-16,20,23,25H,13-14H2,1-4H3,(H,24,26).
What are the key properties of N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide?
N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide has a molecular weight of 354.49 g/mol, XLogP of 4.20, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,6-di(propan-2-yl)phenyl]-2-[(2-hydroxy-2-phenylethyl)amino]acetamide is sourced from PubChem (CID 4878605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).