N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide

C13H26N2O2 — CID 75504703

IUPACN-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide
SMILESCC(NC(C)C1CCCO1)C(=O)N(C)C(C)C
InChIInChI=1S/C13H26N2O2/c1-9(2)15(5)13(16)11(4)14-10(3)12-7-6-8-17-12/h9-12,14H,6-8H2,1-5H3
InChIKeyLUZQYYNDCDZPIK-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.40
Rot. Bonds5

About N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide

N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide (PubChem CID 75504703) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide
PubChem CID75504703
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide
SMILESCC(NC(C)C1CCCO1)C(=O)N(C)C(C)C
InChIInChI=1S/C13H26N2O2/c1-9(2)15(5)13(16)11(4)14-10(3)12-7-6-8-17-12/h9-12,14H,6-8H2,1-5H3
InChIKeyLUZQYYNDCDZPIK-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide?
The IUPAC name of N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide (CID 75504703) is N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide.
What is the SMILES notation for N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide?
The canonical SMILES for N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide is CC(NC(C)C1CCCO1)C(=O)N(C)C(C)C.
What is the InChIKey of N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide?
The InChIKey is LUZQYYNDCDZPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-9(2)15(5)13(16)11(4)14-10(3)12-7-6-8-17-12/h9-12,14H,6-8H2,1-5H3.
What are the key properties of N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide?
N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide has a molecular weight of 242.36 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-(oxolan-2-yl)ethylamino]-N-propan-2-ylpropanamide is sourced from PubChem (CID 75504703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).