2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide

C15H30N2O3 — CID 75505726

IUPAC2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide
SMILESCOC(C)(C)CC(C)NC(=O)N1CCCC1C(C)(C)O
InChIInChI=1S/C15H30N2O3/c1-11(10-14(2,3)20-6)16-13(18)17-9-7-8-12(17)15(4,5)19/h11-12,19H,7-10H2,1-6H3,(H,16,18)
InChIKeyZBFYBWIONYCBPD-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.13
Rot. Bonds5

About 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide

2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide (PubChem CID 75505726) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide
PubChem CID75505726
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC Name2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide
SMILESCOC(C)(C)CC(C)NC(=O)N1CCCC1C(C)(C)O
InChIInChI=1S/C15H30N2O3/c1-11(10-14(2,3)20-6)16-13(18)17-9-7-8-12(17)15(4,5)19/h11-12,19H,7-10H2,1-6H3,(H,16,18)
InChIKeyZBFYBWIONYCBPD-UHFFFAOYSA-N
XLogP2.13
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide?
The IUPAC name of 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide (CID 75505726) is 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide is COC(C)(C)CC(C)NC(=O)N1CCCC1C(C)(C)O.
What is the InChIKey of 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide?
The InChIKey is ZBFYBWIONYCBPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-11(10-14(2,3)20-6)16-13(18)17-9-7-8-12(17)15(4,5)19/h11-12,19H,7-10H2,1-6H3,(H,16,18).
What are the key properties of 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide?
2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxypropan-2-yl)-N-(4-methoxy-4-methylpentan-2-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 75505726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).