2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide

C14H28N2O2 — CID 3229586

IUPAC2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide
SMILESCC(NCC1CCCO1)C(=O)N(C(C)C)C(C)C
InChIInChI=1S/C14H28N2O2/c1-10(2)16(11(3)4)14(17)12(5)15-9-13-7-6-8-18-13/h10-13,15H,6-9H2,1-5H3
InChIKeyNCETZSSCAXGGDG-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.79
Rot. Bonds6

About 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide

2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide (PubChem CID 3229586) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide.

Molecular Properties

Compound Name2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide
PubChem CID3229586
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide
SMILESCC(NCC1CCCO1)C(=O)N(C(C)C)C(C)C
InChIInChI=1S/C14H28N2O2/c1-10(2)16(11(3)4)14(17)12(5)15-9-13-7-6-8-18-13/h10-13,15H,6-9H2,1-5H3
InChIKeyNCETZSSCAXGGDG-UHFFFAOYSA-N
XLogP1.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide?
The IUPAC name of 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide (CID 3229586) is 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide.
What is the SMILES notation for 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide?
The canonical SMILES for 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide is CC(NCC1CCCO1)C(=O)N(C(C)C)C(C)C.
What is the InChIKey of 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide?
The InChIKey is NCETZSSCAXGGDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-10(2)16(11(3)4)14(17)12(5)15-9-13-7-6-8-18-13/h10-13,15H,6-9H2,1-5H3.
What are the key properties of 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide?
2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide has a molecular weight of 256.39 g/mol, XLogP of 1.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-ylmethylamino)-N,N-di(propan-2-yl)propanamide is sourced from PubChem (CID 3229586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).