2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide

C15H23N3O3 — CID 60846458

IUPAC2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide
SMILESCC(C)Oc1ccc(C(C)NC(=O)CNC(=O)CN)cc1
InChIInChI=1S/C15H23N3O3/c1-10(2)21-13-6-4-12(5-7-13)11(3)18-15(20)9-17-14(19)8-16/h4-7,10-11H,8-9,16H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyVLWVHFDSXGBACE-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.73
Rot. Bonds7

About 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide

2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide (PubChem CID 60846458) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide
PubChem CID60846458
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide
SMILESCC(C)Oc1ccc(C(C)NC(=O)CNC(=O)CN)cc1
InChIInChI=1S/C15H23N3O3/c1-10(2)21-13-6-4-12(5-7-13)11(3)18-15(20)9-17-14(19)8-16/h4-7,10-11H,8-9,16H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyVLWVHFDSXGBACE-UHFFFAOYSA-N
XLogP0.73
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-[1-(4-methylphenyl)ethylamino]-2-oxoethyl]acetamide
CID 54861871
3-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide;hydrochloride
CID 119285649
2-amino-N-[2-oxo-2-(1-pyridin-4-ylethylamino)ethyl]acetamide
CID 60848302
2-amino-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81364080
2-amino-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide;hydrochloride
CID 119328681
2-(4-methoxyphenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
CID 134060669
2-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide
CID 43699540
5-chloro-N-[1-(4-propan-2-yloxyphenyl)ethyl]pentanamide
CID 43696732
2-(4-formylphenoxy)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
CID 78867601
N-ethyl-2-[1-(4-propan-2-yloxyphenyl)ethylamino]acetamide
CID 43566886
2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide
CID 119311263
2-amino-2-methyl-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide
CID 61264808

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide?
The IUPAC name of 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide (CID 60846458) is 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide is CC(C)Oc1ccc(C(C)NC(=O)CNC(=O)CN)cc1.
What is the InChIKey of 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide?
The InChIKey is VLWVHFDSXGBACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-10(2)21-13-6-4-12(5-7-13)11(3)18-15(20)9-17-14(19)8-16/h4-7,10-11H,8-9,16H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide?
2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide has a molecular weight of 293.37 g/mol, XLogP of 0.73, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide is sourced from PubChem (CID 60846458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).