N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide

C14H27N3O3 — CID 3069836

IUPACN-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide
SMILESCC(C)N(CCNC(=O)CN1CCC(O)C1=O)C(C)C
InChIInChI=1S/C14H27N3O3/c1-10(2)17(11(3)4)8-6-15-13(19)9-16-7-5-12(18)14(16)20/h10-12,18H,5-9H2,1-4H3,(H,15,19)
InChIKeyNBKLNJPHCZCBFB-UHFFFAOYSA-N
MW285.39 g/mol
LogP-0.19
Rot. Bonds7

About N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide

N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide (PubChem CID 3069836) has the molecular formula C14H27N3O3 and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide
PubChem CID3069836
Molecular FormulaC14H27N3O3
Molecular Weight285.39 g/mol
Exact Mass285.21
IUPAC NameN-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide
SMILESCC(C)N(CCNC(=O)CN1CCC(O)C1=O)C(C)C
InChIInChI=1S/C14H27N3O3/c1-10(2)17(11(3)4)8-6-15-13(19)9-16-7-5-12(18)14(16)20/h10-12,18H,5-9H2,1-4H3,(H,15,19)
InChIKeyNBKLNJPHCZCBFB-UHFFFAOYSA-N
XLogP-0.19
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide (CID 3069836) is N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide is CC(C)N(CCNC(=O)CN1CCC(O)C1=O)C(C)C.
What is the InChIKey of N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is NBKLNJPHCZCBFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O3/c1-10(2)17(11(3)4)8-6-15-13(19)9-16-7-5-12(18)14(16)20/h10-12,18H,5-9H2,1-4H3,(H,15,19).
What are the key properties of N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide?
N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 285.39 g/mol, XLogP of -0.19, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[di(propan-2-yl)amino]ethyl]-2-(3-hydroxy-2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 3069836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).