N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide

C17H26N2O — CID 115672861

IUPACN-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide
SMILESCc1cc(C)c(C(C)NC(C)C(=O)NC2CC2)c(C)c1
InChIInChI=1S/C17H26N2O/c1-10-8-11(2)16(12(3)9-10)13(4)18-14(5)17(20)19-15-6-7-15/h8-9,13-15,18H,6-7H2,1-5H3,(H,19,20)
InChIKeyHDFKWPJQMKVDDS-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.93
Rot. Bonds5

About N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide

N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide (PubChem CID 115672861) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide
PubChem CID115672861
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide
SMILESCc1cc(C)c(C(C)NC(C)C(=O)NC2CC2)c(C)c1
InChIInChI=1S/C17H26N2O/c1-10-8-11(2)16(12(3)9-10)13(4)18-14(5)17(20)19-15-6-7-15/h8-9,13-15,18H,6-7H2,1-5H3,(H,19,20)
InChIKeyHDFKWPJQMKVDDS-UHFFFAOYSA-N
XLogP2.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide?
The IUPAC name of N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide (CID 115672861) is N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide is Cc1cc(C)c(C(C)NC(C)C(=O)NC2CC2)c(C)c1.
What is the InChIKey of N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide?
The InChIKey is HDFKWPJQMKVDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-10-8-11(2)16(12(3)9-10)13(4)18-14(5)17(20)19-15-6-7-15/h8-9,13-15,18H,6-7H2,1-5H3,(H,19,20).
What are the key properties of N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide?
N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide has a molecular weight of 274.41 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1-(2,4,6-trimethylphenyl)ethylamino]propanamide is sourced from PubChem (CID 115672861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).